SCHEMBL5076555

SCHEMBL5076555

CC(O)N(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 3/20 0.44
ADRA2C P18825 2/20 0.44
ADRA2A P08913 1/20 0.44
HIF1A Q16665 1/20 0.44
AOC3 Q16853 2/20 0.43
ALOX5 P09917 1/20 0.42
CYP2C9 P11712 2/20 0.41
CHRM2 P08172 1/20 0.41
ADRA1A P35348 1/20 0.41
RGS12 O14924 1/20 0.41
GLA P06280 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
PKM P14618 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
ALOX12 P18054 1/20 0.41
NFKB1 P19838 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11697235 0.89 SLC6A2 (0.44) ALDH1A1KDM4ELMNAADRA2CADRA2A
SCHEMBL28356338 0.80 ALDH1A1 (0.48) ALDH1A1KDM4ELMNAADRA2CADRA2A
SCHEMBL104211 0.79 POLB (0.44) ALDH1A1KDM4ELMNAADRA2CADRA2A
SCHEMBL11697724 0.78 ALDH1A1 (0.41) ALDH1A1KDM4ELMNAADRA2CADRA2A
Isopropyldiphenylamine SCHEMBL2119060 0.78 ALDH1A1 (0.50) ALDH1A1KDM4ELMNAADRA2CADRA2A
Isopropyldiphenylamine SCHEMBL2119054 0.78 ALDH1A1 (0.50) ALDH1A1KDM4ELMNAADRA2CADRA2A
SCHEMBL11697906 0.77 ALDH1A1 (0.46) ALDH1A1LMNAALOX5TSHRCYP2C19
SCHEMBL9354511 0.77 ALOX5 (0.41) ALDH1A1KDM4ELMNAADRA2CADRA2A
SCHEMBL12157017 0.77 SLC6A2 (0.48) ALDH1A1KDM4ELMNAAOC3CYP2C9
SCHEMBL1674657 0.77 SLC6A2 (0.48) ALDH1A1KDM4ELMNAAOC3CYP2C9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 79 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116898982-A Supermolecule nano-drug carrier for chiral drug selective capture and controllable release and preparation method thereof 云南师范大学 2023-10-20 CN claimed
CN-107954737-A A kind of building and ornament materials with purifying formaldehyde and preparation method thereof 秦素洁 2018-04-24 CN claimed
CN-107952491-A A kind of nanocomposite for purifying formaldehyde and preparation method thereof 秦素洁 2018-04-24 CN claimed
CN-107952354-A It is a kind of to be used to absorb fluent material of formaldehyde and preparation method thereof 秦素洁 2018-04-24 CN claimed
CN-107953424-A A kind of wood materials with purifying formaldehyde and preparation method thereof 秦素洁 2018-04-24 CN claimed
CN-107952367-A A kind of porous material for high-efficient purification formaldehyde and preparation method thereof 秦素洁 2018-04-24 CN claimed
CN-107952362-A It is a kind of to be used for rapidly and efficiently solid composite material of purifying formaldehyde and preparation method thereof 秦素洁 2018-04-24 CN claimed
CN-107952289-A A kind of filter screen with purifying formaldehyde and preparation method thereof 秦素洁 2018-04-24 CN claimed
EP-1274746-B1 SINGLE-SITE CATALYSTS CONTAINING CHELATING N-OXIDE LIGANDS EQUISTAR CHEM LP (US) 2008-08-20 EP claimed
US-7087549-B2 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2006-08-08 US claimed
US-20050181935-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2005-08-18 US claimed
EP-0990670-B1 Calcium-based catalyst system GOODYEAR TIRE & RUBBER (US) 2004-11-03 EP claimed
US-20020045720-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2002-04-18 US claimed
US-6359088-B1 COPOLYMERIZING STYRENE AND 1,3-BUTADIENE IN AN ORGANIC SOLVENT IN THE PRESENCE OF CATALYST SYSTEM WHICH CONSISTS ESSENTIALLY OF AN ORGANOLITHIUM COMPOUND, A CALCIUM ALKOXIDE AND A LITHIUM ALKOXIDE THE GOODYEAR TIRE & RUBBER COMPANY 2002-03-19 US claimed
US-6103842-A USING CATALYST SYSTEM FOR EXOTHERMAL POLYMERIZATION WHICH CONSISTS ESSENTIALLY OF (A) AN ORGANOLITHIUM COMPOUND, (B) A BARIUM ALKOXIDE AND (C) A LITHIUM ALKOXIDE THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-08-15 US claimed
EP-0990670-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-04-05 EP claimed
EP-0391692-B1 Process for producing high trans low vinyl conjugated diene (co) polymer JAPAN SYNTHETIC RUBBER CO LTD (JP) 1994-01-05 EP claimed
US-5086136-A Using coordination catalyst containing organoaluminum compound, barium compound and alcohol JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-02-04 US claimed
EP-0391692-A1 Process for producing high trans low vinyl conjugated diene (co) polymer JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1990-10-10 EP claimed
EP-4342927-B1 POLYURETHANE RESIN COMPOSITION, CURED PRODUCT, ARTIFICIAL LEATHER, SYNTHETIC LEATHER, AND SURFACE TREATMENT AGENT FOR LEATHER TOSOH CORP (JP) 2026-03-18 EP disclosed
EP-4674889-A1 COMPOSITION AND METHOD FOR PRODUCING SAME, URETHANE RESIN, AQUEOUS URETHANE RESIN DISPERSION, AND COATING AGENT Tosoh Corporation (JP) 2026-01-07 EP disclosed
US-20250304741-A1 COMPOUND, METHOD FOR PRODUCING SAME, COMPOSITION, URETHANE RESIN, AQUEOUS URETHANE RESIN DISPERSION, AND COATING AGENT TOSOH CORPORATION (JP) 2025-10-02 US disclosed
US-20250163203-A1 POLYURETHANE RESIN COMPOSITION, ARTIFICIAL LEATHER, SYNTHETIC LEATHER, AND SURFACE TREATMENT AGENT FOR LEATHER TOSOH CORPORATION (JP) 2025-05-22 US disclosed
EP-4495164-A1 COMPOUND, METHOD FOR PRODUCING SAME, COMPOSITION, URETHANE RESIN, AQUEOUS URETHANE RESIN DISPERSION, AND COATING AGENT Tosoh Corporation (JP) 2025-01-22 EP disclosed
EP-4480981-A1 POLYURETHANE RESIN COMPOSITION, ARTIFICIAL LEATHER, SYNTHETIC LEATHER, AND LEATHER SURFACE TREATMENT AGENT Tosoh Corporation (JP) 2024-12-25 EP disclosed
WO-2024202836-A1 COMPOSITION AND METHOD FOR PRODUCING SAME, URETHANE RESIN, AQUEOUS URETHANE RESIN DISPERSION, AND COATING AGENT 東ソー株式会社 2024-10-03 WO disclosed
US-12065542-B2 Polycarbonate polyol and method for producing same, composition and method for producing same, urethane resin and aqueous urethane resin dispersion TOSOH CORPORATION (JP) 2024-08-20 US disclosed
EP-4342927-A1 POLYURETHANE RESIN COMPOSITION, CURED PRODUCT, ARTIFICIAL LEATHER, SYNTHETIC LEATHER, AND SURFACE TREATMENT AGENT FOR LEATHER Tosoh Corporation (JP) 2024-03-27 EP disclosed
US-11939426-B2 2024-03-26 US disclosed
US-20230348670-A1 POLYCARBONATE POLYOL AND METHOD FOR PRODUCING SAME, COMPOSITION AND METHOD FOR PRODUCING SAME, URETHANE RESIN AND AQUEOUS URETHANE RESIN DISPERSION TOSOH CORPORATION (JP) 2023-11-02 US disclosed
CN-116898982-A Supermolecule nano-drug carrier for chiral drug selective capture and controllable release and preparation method thereof 云南师范大学 2023-10-20 CN disclosed
CN-116898982-A Supermolecule nano-drug carrier for chiral drug selective capture and controllable release and preparation method thereof 云南师范大学 2023-10-20 CN disclosed
WO-2023199756-A1 COMPOUND, METHOD FOR PRODUCING SAME, COMPOSITION, URETHANE RESIN, AQUEOUS URETHANE RESIN DISPERSION, AND COATING AGENT 東ソー株式会社 2023-10-19 WO disclosed
WO-2023157807-A1 POLYURETHANE RESIN COMPOSITION, ARTIFICIAL LEATHER, SYNTHETIC LEATHER, AND LEATHER SURFACE TREATMENT AGENT 東ソー株式会社 2023-08-24 WO disclosed
EP-4212337-A1 POLYCARBONATE POLYOL AND METHOD FOR PRODUCING SAME, COMPOSITION AND METHOD FOR PRODUCING SAME, URETHANE RESIN AND AQUEOUS URETHANE RESIN DISPERSION Tosoh Corporation (JP) 2023-07-19 EP disclosed
CN-116203180-A Quality control method of ephedra herb medicine 石家庄以岭药业股份有限公司 2023-06-02 CN disclosed
CN-116165321-A Quality control method of houttuynia cordata medicinal material 石家庄以岭药业股份有限公司 2023-05-26 CN disclosed
US-7087549-B2 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2006-08-08 US disclosed
EP-1507511-B1 PERSONAL CARE COMPOSITIONS WITH HYDROXY AMINE NEUTRALIZED POLYMERS UNILEVER PLC (GB) 2006-07-26 EP disclosed
US-20050181935-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2005-08-18 US disclosed
EP-1507511-A1 PERSONAL CARE COMPOSITIONS WITH HYDROXY AMINE NEUTRALIZED POLYMERS UNILEVER PLC (GB) 2005-02-23 EP disclosed
EP-1507512-A1 COSMETIC COMPOSITIONS WITH HYDROXY AMINE SALTS OF MALONIC ACID UNILEVER PLC (GB) 2005-02-23 EP disclosed
US-20040241131-A1 Compositions containing malonate salts in preventing in-grown hair arising from shaving UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-12-02 US disclosed
EP-0990670-B1 Calcium-based catalyst system GOODYEAR TIRE & RUBBER (US) 2004-11-03 EP disclosed
EP-1057843-B1 Aqueous emulsion, process for producing the same and aqueous paint and aqueous printing ink comprising the same NIPPON POLYURETHANE KOGYO KK (JP) 2004-09-15 EP disclosed
WO-2003099253-A1 PERSONAL CARE COMPOSITIONS WITH HYDROXY AMINE NEUTRALIZED POLYMERS UNILEVER PLC (GB) 2003-12-04 WO disclosed
WO-2003099252-A1 COSMETIC COMPOSITIONS WITH HYDROXY AMINE SALTS OF MALONIC ACID UNILEVER PLC (GB) 2003-12-04 WO disclosed
US-20030224023-A1 Cosmetic compositions with hydroxy amine salts of malonic acid UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-12-04 US disclosed
US-20020045720-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2002-04-18 US disclosed
US-6359088-B1 COPOLYMERIZING STYRENE AND 1,3-BUTADIENE IN AN ORGANIC SOLVENT IN THE PRESENCE OF CATALYST SYSTEM WHICH CONSISTS ESSENTIALLY OF AN ORGANOLITHIUM COMPOUND, A CALCIUM ALKOXIDE AND A LITHIUM ALKOXIDE THE GOODYEAR TIRE & RUBBER COMPANY 2002-03-19 US disclosed
US-6309507-B1 HEAT RESISTANCE, DURABILITY; HIGH BONDING STRENGTH TO METAL FOILS AND POLYOLEFINS NIPPON POLYURETHANE INDUSTRY CO., LTD. (JP) 2001-10-30 US disclosed
US-6306947-B1 Printing ink and paint composed of an aqueous emulsion of self-emulsifiable urethane copolymer NIPPON POLYURETHANE INDUSTRY CO., LTD. (JP) 2001-10-23 US disclosed
EP-1057843-A1 Aqueous emulsion, process for producing the same and aqueous paint and aqueous printing ink comprising the same NIPPON POLYURETHANE INDUSTRY CO. LTD. (JP) 2000-12-06 EP disclosed
US-6103842-A USING CATALYST SYSTEM FOR EXOTHERMAL POLYMERIZATION WHICH CONSISTS ESSENTIALLY OF (A) AN ORGANOLITHIUM COMPOUND, (B) A BARIUM ALKOXIDE AND (C) A LITHIUM ALKOXIDE THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-08-15 US disclosed
EP-0990670-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-04-05 EP disclosed
EP-0609010-B1 A process for producing a diolefin polymer or copolymer and a rubber composition containing such a diolefin polymer or copolymer BRIDGESTONE CORP (JP) 2000-03-15 EP disclosed
EP-0877034-A1 Random trans SBR with low vinyl microstructure THE GOODYEAR TIRE & RUBBER COMPANY (US) 1998-11-11 EP disclosed
US-5527860-A PROMOTER IS REACTION PRODUCT OF A SECONDARY AMINE AND ORGANOLITHIUM COMPOUND OR ALCOHOL AND A LITHIUM ALKOXIDE JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1996-06-18 US disclosed
EP-0609010-A2 A process for producing a diolefin polymer or copolymer and a rubber composition containing such a diolefin polymer or copolymer BRIDGESTONE CORPORATION (JP) 1994-08-03 EP disclosed
EP-0400435-B1 Carbonic half-ester of betaine structure BASF AG (DE) 1994-04-13 EP disclosed
EP-0391692-B1 Process for producing high trans low vinyl conjugated diene (co) polymer JAPAN SYNTHETIC RUBBER CO LTD (JP) 1994-01-05 EP disclosed
US-5100965-A Process for synthesizing high trans polymers THE GOODYEAR TIRE & RUBBER COMPANY (US) 1992-03-31 US disclosed
US-5086136-A Using coordination catalyst containing organoaluminum compound, barium compound and alcohol JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-02-04 US disclosed
EP-0331400-B1 CATALYST COMPOSITION FOR POLYMERIZATION OF CONJUGATED DIENE AND PROCESS FOR PRODUCING CONJUGATED DIENE POLYMER JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-01-08 EP disclosed
EP-0400435-A2 Carbonic half-ester of betaine structure BASF Aktiengesellschaft (DE) 1990-12-05 EP disclosed
US-4933401-A ORGANO-LITHIUM-ALUMINUM COMPOUND JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1990-06-12 US disclosed
EP-0331400-A1 Catalyst composition for polymerization of conjugated diene and process for producing conjugated diene polymer JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1989-09-06 EP disclosed
EP-0289262-A2 Omega-quaternary ammonium alkyl esters and thioesters of acidic nonsteroidal antiinflammatory drugs SYNTEX PHARMACEUTICALS INTERNATIONAL LIMITED (BM) 1988-11-02 EP disclosed
US-4599090-A TERTIARY AMINE ETHER THE LUBRIZOL CORPORATION (US) 1986-07-08 US disclosed
US-4477362-A FROM AN ALIPHATIC ALCOHOL AND A TERTIARY AMINO ALCOHOL THE LUBRIZOL CORPORATION (US) 1984-10-16 US disclosed
US-4438094-A Cosmetic formulations containing oxyethylated diphenylamines as sun screen agents BASF AKTIENGESELLSCHAFT (DE) 1984-03-20 US disclosed
US-4431585-A THIAZOLE AND THIOPHENE DYES; DIAZOTIZATION; COUPLING CASSELLA AKTIENGESELLSCHAFT (DE) 1984-02-14 US disclosed
US-4294940-A A CATIONIC POLYMER OF A CONJUGATED DIENE MODIFIED BY AN UNSATURATED ACID OR ANHYDRIDE, ALCOHOL OR AMINE, EPOXY COMPOUND, AND BLOCKED POLYISOCYANATE; AUTO PAINTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-10-13 US disclosed
EP-0035671-A1 Water-insoluble azo dyestuffs, methods for their preparation and their use in dyeing and printing synthetic hydrophobic fibre materials CASSELLA Aktiengesellschaft (DE) 1981-09-16 EP disclosed
US-4095022-A PHOSPHORUS COMPOUNDS, SILICA-ALUMINA CATALYST TEXACO DEVELOPMENT CORPORATION (US) 1978-06-13 US disclosed
US-4063887-A HYDROXYAMINE COMPOUND CELANESE CORPORATION (US) 1977-12-20 US disclosed
US-4041025-A FOR HYDROPHOBIC FIBERS SUCH AS POLYESTERS, YELLOW TO BLUE-GREEN SHADES BASF AKTIENGESELLSCHAFT (DT) 1977-08-09 US disclosed
US-4026935-A FROM N-(HYDROXYALKYL)-MORPHOLINE COMPOUND, SILICA-ALUMINA CATALYST TEXACO DEVELOPMENT CORPORATION (US) 1977-05-31 US disclosed
US-4009201-A PARTIALLY OR FULLY QUATERNIZED POLYAMINE ESTERS OF ACRYLIC ACIDS ALCOLAC INC. (US) 1977-02-22 US disclosed
US-4009201-A PARTIALLY OR FULLY QUATERNIZED POLYAMINE ESTERS OF ACRYLIC ACIDS ALCOLAC INC. (US) 1977-02-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030224023-A1 Cosmetic compositions with hydroxy amine salts of malonic acid CUTA, TYR, DDC ALDH1A1 281/4885KDM4E 42/4885LMNA 3389/4885
US-20040241131-A1 Compositions containing malonate salts in preventing in-grown hair arising from shaving DPM1, POLR1C, MSH6 ALDH1A1 669/4885KDM4E 188/4885LMNA 2114/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.