SCHEMBL9140288

SCHEMBL9140288

O=C(O)Cc1ccc(CC2CCCC/C2=N/O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 4/20 0.40
PTGS2 P35354 3/20 0.40
KMT2A Q03164 3/20 0.40
HTT P42858 2/20 0.40
OPRK1 P41145 1/20 0.40
CA2 P00918 1/20 0.40
CAMK2A Q9UQM7 1/20 0.40
ENPP2 Q13822 1/20 0.38
AKR1B1 P15121 1/20 0.38
ABCC4 O15439 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
SRD5A2 P31213 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL9140291 1.00 PTGS1 (0.40) PTGS1PTGS2KMT2AHTTOPRK1
SCHEMBL9138676 0.97 PTGS1 (0.43) PTGS1PTGS2KMT2AHTTOPRK1
SCHEMBL9138675 0.97 PTGS1 (0.43) PTGS1PTGS2KMT2AHTTOPRK1
SCHEMBL8230399 0.84 KDM4E (0.44) PTGS1PTGS2KMT2AHTTOPRK1
SCHEMBL11640859 0.84 KDM4E (0.44) PTGS1PTGS2KMT2AHTTOPRK1
Lysine SCHEMBL11543542 0.83 GSR (0.41) PTGS1PTGS2KMT2AHTTOPRK1
Lysine SCHEMBL11543534 0.83 GSR (0.41) PTGS1PTGS2KMT2AHTTOPRK1
SCHEMBL11792482 0.83 KDM4E (0.43) PTGS1PTGS2KMT2AHTTOPRK1
SCHEMBL11792486 0.83 KDM4E (0.43) PTGS1PTGS2KMT2AHTTOPRK1
SCHEMBL9141017 0.81 CYP4Z1 (0.42) PTGS1PTGS2KMT2AHTTOPRK1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4161538-A 4-(2-OXO- OR HYDROXIMINO-CYCLOALKAN-1-YLMETHYL)-PHENYLACETIC ACID, ANTIINFLAMMATORY AGENTS SANKYO COMPANY LIMITED (JP) 1979-07-17 US claimed
US-5476846-A Administering anti-thrombotic and anti-asthmatic agent LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1995-12-19 US disclosed
US-5387709-A Bronchodilator agents, anticoagulants, vasodilation LIPHA LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1995-02-07 US disclosed
EP-0472449-B1 Substituted sulfonamides, processes for their preparation and medicines containing them LIPHA (FR) 1994-09-14 EP disclosed
EP-0472449-A2 Substituted sulfonamides, processes for their preparation and medicines containing them LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) 1992-02-26 EP disclosed
US-4161538-A 4-(2-OXO- OR HYDROXIMINO-CYCLOALKAN-1-YLMETHYL)-PHENYLACETIC ACID, ANTIINFLAMMATORY AGENTS SANKYO COMPANY LIMITED (JP) 1979-07-17 US disclosed