SCHEMBL499776

SCHEMBL499776

C=C(C)C(=O)OC(CCC)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
TSHR P16473 3/20 0.38
THRB P10828 1/20 0.35
CHRM1 P11229 1/20 0.30
AKR1A1 P14550 1/20 0.30
CHRM3 P20309 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 1/20 0.30
SLC6A3 Q01959 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
Iodide SCHEMBL1301964 0.98 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
Bromide SCHEMBL1302282 0.98 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
Fluoride SCHEMBL1302502 0.98 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
Hydrochloric Acid SCHEMBL1302156 0.98 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
SCHEMBL500186 0.89 TSHR (0.43) ALDH1A1TSHRTHRB
SCHEMBL5053972 0.88 TSHR (0.46) TSHR
SCHEMBL15554493 0.87 THRB (0.31) ALDH1A1TSHRTHRB
SCHEMBL499761 0.86 TSHR (0.49) TSHR
SCHEMBL11785301 0.86 TSHR (0.49) TSHR
SCHEMBL499942 0.86 TSHR (0.49) TSHR

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 319 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117986498-A Butyl benzene copolymer composite latex and preparation method and application thereof 南通腾龙化工科技有限公司 2024-05-07 CN claimed
CN-117965230-A Lubricating oil composition for oil-cooled motor pure electric vehicle reduction gearbox and preparation method thereof 济南佳进新材料有限公司 2024-05-03 CN claimed
CN-117924621-A Multiphase structure modified styrene-butadiene copolymer composite latex 广东诚铭化学技术开发有限公司 2024-04-26 CN claimed
CN-104685035-B For separating the NVP base cation copolymer of O/w emulsion 陶氏环球技术有限责任公司 2016-09-14 CN claimed
EP-2880130-B1 METHOD FOR SEPARATING AN OIL-IN-WATER EMULSION WITH N-VINYLPYRROLIDONE-BASED CATIONIC COPOLYMER DOW GLOBAL TECHNOLOGIES LLC (US) 2016-08-24 EP claimed
CN-104685035-A N-vinylpyrrolidone-based cationic copolymer for separating an oil-in-water emulsion DOW GLOBAL TECHNOLOGIES INC 2015-06-03 CN claimed
US-RE39450-E1 Polyvinylpyrridinium derivatives as anti-dye transfer agents NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CO (US) 2006-12-26 US claimed
EP-1167504-B1 Polyvinylpyrridinium derivatives as anti-dye transfer agents NAT STARCH CHEM INVEST (US) 2004-10-06 EP claimed
EP-1167504-A1 Polyvinylpyrridinium derivatives as anti-dye transfer agents National Starch and Chemical Investment Holding Corporation (US) 2002-01-02 EP claimed
EP-1083218-A1 Quaternary polyvinylpyrridinium derivatives as anti-dye transfer agents National Starch and Chemical Investment Holding Corporation (US) 2001-03-14 EP claimed
US-5760136-A FORMING AN ADDITION-CONDENSATION COPOLYMER BY POLYMERIZING AN AZO-CONTAINING POLYSILOXANE AND AN UNSATURATED MONOMER; CATIONIC AND NONIONIC POLYMERS; POLYAMPHOLYTES; COATINGS; ADHESIVES; PAINTS; HAIR COSMETICS WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1998-06-02 US claimed
US-5321110-A Thickeners for shampoo, hair conditioners ISP INVESTMENTS INC. (US) 1994-06-14 US claimed
US-5262244-A Hydrophilic copolymers and their use in reprography HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-16 US claimed
US-5178961-A Terpolymer containing N-butoxymethyl methacrylamide monomer; offset printing; lithography HOECHST AKTIENGESELLSCHAFT (DE) 1993-01-12 US claimed
US-5115036-A Ethylene-aminoalkyl (meth)acrylate copolymer; waste water treatment SUMITOMO CHEMICAL CO., LTD. (JP) 1992-05-19 US claimed
US-5064879-A METHOD FOR SORBING METALLIC IONS USING ETHYLENE-N,N-DIALKYL AMINOALKYL ACRYLATES POLYMERS SUMITOMO CHEMICAL CO., LTD. (JP) 1991-11-12 US claimed
EP-0340975-A1 Ethylene copolymers as sorbers of metallic ions from solutions SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-11-08 EP claimed
US-4877687-A SURFACE TREATMENT WITH A QUATERNIZED ACRYLATED RESIN MITSUBISHI RAYON COMPANY, LTD. (JP) 1989-10-31 US claimed
EP-0106193-A2 Liquid skin cleanser composition UNION CARBIDE CORPORATION (US) 1984-04-25 EP claimed
US-3954960-A Hair and similar cosmetic preparations containing a quaternized copolymer of vinyl pyrrolidone GAF CORPORATION (US) 1976-05-04 US claimed