SCHEMBL132503

SCHEMBL132503

CC(c1ccccc1)c1ccccc1.N=C=O.N=C=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.41
MIF P14174 2/20 0.40
TYR P14679 1/20 0.39
TAAR1 Q96RJ0 3/20 0.39
ESR1 P03372 1/20 0.39
PDCD1 Q15116 1/20 0.39
ESR2 Q92731 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
KMT2A Q03164 1/20 0.38
CYP2D6 P10635 2/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2C P18825 1/20 0.38
LMNA P02545 1/20 0.38
HIF1A Q16665 1/20 0.38
KDM4E B2RXH2 1/20 0.38
SRC P12931 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ALOX5 P09917 1/20 0.36

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
SCHEMBL4808563 1.00 DAO (0.41) DAOMIFTYRTAAR1ESR1
SCHEMBL3384898 1.00 DAO (0.41) DAOMIFTYRTAAR1ESR1
Benzene SCHEMBL28319276 0.98 KMT2A (0.41) DAOMIFTYRTAAR1ESR1
Water SCHEMBL11440439 0.98 DAO (0.40) DAOMIFTYRTAAR1ESR1
Isopropylbenzene SCHEMBL133881 0.85 CYP2C9 (0.41) MIFTYRTAAR1CYP2D6ADRA2A
Isopropylbenzene SCHEMBL1347599 0.85 CYP2C9 (0.41) MIFTYRTAAR1CYP2D6ADRA2A
SCHEMBL28845471 0.84 ACP3 (0.47) DAOTYR
SCHEMBL7499823 0.84 TAAR1 (0.50) TYRTAAR1ESR1PDCD1ESR2
SCHEMBL169730 0.84 TAAR1 (0.50) TYRTAAR1ESR1PDCD1ESR2
Benzene SCHEMBL28192760 0.84 TAAR1 (0.50) TYRTAAR1ESR1PDCD1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119306910-B Low-reaction-heat mining reinforcing material and preparation method thereof 山东一诺威新材料有限公司 2025-05-16 CN claimed
CN-119529704-A Polyurethane composite adhesive film for bonding light down jackets and preparation method thereof 广东盈通新材料有限公司 2025-02-28 CN claimed
US-20240084085-A1 PREPARATION FOR A MOLDED BODY BASF SE (DE) 2024-03-14 US claimed
US-20230407153-A1 DE-BONDABLE POLYURETHANE ADHESIVES BASED ON THERMALLY EXPANDABLE MICROSPHERES BASF SE (DE) 2023-12-21 US claimed
WO-2023194225-A1 POLYURETHANE COMPOSITION FOR VAPOR BARRIER IN THE BUILDING WITH LOW INDOOR TEMPERATURE BASF SE (DE) 2023-10-12 WO claimed
CN-116829630-A Method for producing molded bodies 巴斯夫欧洲公司 2023-09-29 CN claimed
EP-4222189-A1 DE-BONDABLE POLYURETHANE ADHESIVES BASED ON THERMALLY EXPANDABLE MICROSPHERES BASF SE (DE) 2023-08-09 EP claimed
US-11401365-B2 Thermoplastic polyoxazolidones from diisocyanates and diglycidyl ether of 2-phenyl- 1,3-propanediol derivaitives BASF SE (DE) 2022-08-02 US claimed
WO-2022069164-A1 DE-BONDABLE POLYURETHANE ADHESIVES BASED ON THERMALLY EXPANDABLE MICROSPHERES BASF SE (DE) 2022-04-07 WO claimed
CN-111108140-B Thermoplastic polyoxazolidinones from diglycidyl ether derivatives of diisocyanates and 2-phenyl-1, 3-propanediol 巴斯夫欧洲公司 2022-02-25 CN claimed
WO-2000018816-A1 PROCESS FOR PRODUCING POLYURETHANES USING BIS-(4- AMINO-2- HALOGENO-3, 5-DIALKYLPHENYL) -METHANE AND ARTICLES PREPARED THEREFROM GAMBRO DIALYSATOREN GMBH & CO. KG (DE) 2000-04-06 WO claimed
US-5948333-A Method for creating imitation marble facade for objects REPLICA PLASTICS (US) 1999-09-07 US claimed
EP-0748400-A1 DURABLE POLYURETHANE FIBER AND METHOD FOR THE MANUFACTURE THEREOF DU PONT-TORAY COMPANY, LTD. (JP) 1996-12-18 EP claimed
WO-1995023883-A1 DURABLE POLYURETHANE FIBER AND METHOD FOR THE MANUFACTURE THEREOF DU PONT-TORAY COMPANY, LTD. (JP) 1995-09-08 WO claimed
EP-0482490-A2 Fractionation process of reaction mixture containing methylene bridged polyphenylene polyisocyanate MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-04-29 EP claimed
EP-0246473-A1 Acrylic modified reactive urethane hot melt adhesive compositions National Starch and Chemical Corporation (US) 1987-11-25 EP claimed
EP-0149388-B1 ISOCYANATE COMPOSITION HAVING A LOW MELTING POINT WITH A DIPHENYL ETHANE STRUCTURE, PROCESS FOR THE PREPARATION THEREOF; USE FOR THE FABRICATION OF POLYURETHANES ELF ATOCHEM S.A. (FR) 1987-08-12 EP claimed
EP-0183790-A4 MOISTURE VAPOR PERMEABLE MATERIALS CONTAINING SEGMENTED BLOCK MULTIPOLYMER. THORATEC LAB CORP (US) 1986-11-10 EP claimed
EP-0183790-A1 MOISTURE VAPOR PERMEABLE MATERIALS CONTAINING SEGMENTED BLOCK MULTIPOLYMER. THORATEC LAB CORP (US) 1986-06-11 EP claimed
WO-1985005373-A1 MOISTURE VAPOR PERMEABLE MATERIALS CONTAINING SEGMENTED BLOCK MULTIPOLYMER THORATEC LABORATORIES CORPORATION (US) 1985-12-05 WO claimed