SCHEMBL43324

SCHEMBL43324

O=C=NC(Cc1ccccc1)(N=C=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KIF11 P52732 6/20 0.40
SMN1; SMN2 Q16637 1/20 0.37
HIF1A Q16665 1/20 0.37
ATM Q13315 1/20 0.37
SLC6A2 P23975 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
FDPS P14324 1/20 0.36
ALDH1A1 P00352 1/20 0.35
KCNA5 P22460 1/20 0.35
CYP3A4 P08684 1/20 0.35
RECQL P46063 1/20 0.35
LMNA P02545 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPK1 P28482 1/20 0.34
IDO1 P14902 1/20 0.33

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
SCHEMBL18919852 0.82 TAAR1 (0.35) CYP1A2CYP2C9CYP2C19HIF1ATAAR1
SCHEMBL4640621 0.81 DRD2 (0.37) CYP1A2CYP2C9CYP2C19KIF11SMN1; SMN2
SCHEMBL17942152 0.78 KCNN4 (0.36) CYP2C19KIF11HIF1ATAAR1ALDH1A1
SCHEMBL7703850 0.78 SMN1; SMN2 (0.41) CYP1A2CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL27678115 0.78 SMN1; SMN2 (0.41) CYP1A2CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL5892151 0.76 KCNN4 (0.34) CYP1A2CYP2C9CYP2C19KIF11HIF1A
SCHEMBL18107094 0.74 SLC6A2 (0.47) CYP1A2CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL11785888 0.74 SLC6A2 (0.52) CYP1A2CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL10942924 0.74 CYP1A2 (0.38) CYP1A2CYP2C9CYP2C19KIF11SMN1; SMN2
Diphenylmethane SCHEMBL9137749 0.73 CALM1 (0.46) CYP1A2CYP2C9CYP2C19ATMTAAR1

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 1286 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4396411-B1 PROCESS FOR THE PREPARATION OF AN ASPHALT MIX COMPOSITION BASF SE (DE) 2025-06-04 EP claimed
US-20250129292-A1 PROCESS FOR PREPARATION OF ASPHALT MIX COMPOSITION, ASPHALT MIX COMPOSITION AND ITS USE BASF SE (DE) 2025-04-24 US claimed
EP-3538578-B1 EXPANDED THERMOPLASTIC POLYURETHANE PARTICLES, METHOD FOR THEIR MANUFACTURE AND METHOD FOR PRODUCING A MOULDED PART BASF SE (DE) 2025-03-05 EP claimed
US-12215183-B2 Expanded thermoplastic polyurethane beads, production thereof and production of a molded part BASF SE (DE) 2025-02-04 US claimed
US-20240360314-A1 PROCESS FOR PREPARATION OF ASPHALT MIX COMPOSITION BASF SE (DE) 2024-10-31 US claimed
CN-113474495-B Method for producing thermoplastic polyurethane fibers with low shrinkage and use of the fibers 巴斯夫欧洲公司 2024-06-14 CN claimed
CN-117940489-A Process for preparing asphalt mixture composition 巴斯夫欧洲公司 2024-04-26 CN claimed
CN-117916425-A Process for preparing an asphalt mixture composition, asphalt mixture composition and use thereof 巴斯夫欧洲公司 2024-04-19 CN claimed
US-20220315757-A1 LOW TVOC FLAME-RETARDANT POLYURETHANE SPRAY FOAM SYSTEM BASF SE (DE) 2022-10-06 US claimed
CN-109952331-B Expanded thermoplastic polyurethane particles, process for producing the same and process for producing moldings 巴斯夫欧洲公司 2022-09-27 CN claimed
WO-1995023883-A1 DURABLE POLYURETHANE FIBER AND METHOD FOR THE MANUFACTURE THEREOF DU PONT-TORAY COMPANY, LTD. (JP) 1995-09-08 WO claimed
US-RE33211-E REACTING THE PRODUCT OF ACETYLENE AND AN ORGANIC POLYOL WITH AN ISOCYANATE ALLIED-SIGNAL INC. (US) 1990-05-08 US claimed
EP-0201710-B1 MATRIX MATERIALS, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE PREPARATION OF COMPOSITE MATERIALS BAYER AG (DE) 1988-11-17 EP claimed
EP-0250969-A1 Process for the preparation of cellular polyurethane elastomers BAYER AG (DE) 1988-01-07 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
US-4659797-A Matrix materials and a process for their preparation BAYER AKTIENGESELLSCHAFT (DE) 1987-04-21 US 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
US-4131693-A Hardenable polyesterurethane composition for producing a directly tinnable wire DR. BECK & CO AG (DE) 1978-12-26 US claimed