SCHEMBL8937246

SCHEMBL8937246

COc1ccc(/C(=C\C(=O)O)c2cccc(C)c2)cc1OC

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 2/20 0.66
WNT3A P56704 2/20 0.66
NPC1 O15118 3/20 0.59
RAB9A P51151 3/20 0.59
POLB P06746 1/20 0.59
PDE4A P27815 5/20 0.53
PDE4B Q07343 5/20 0.53
PDE4C Q08493 5/20 0.53
PDE4D Q08499 5/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA4 P22748 1/20 0.53
CA6 P23280 1/20 0.53
CA7 P43166 1/20 0.53
TPMT P51580 1/20 0.53
CA9 Q16790 1/20 0.53
CA14 Q9ULX7 1/20 0.53
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50

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
SCHEMBL8937250 1.00 CTNNB1 (0.66) CTNNB1WNT3ANPC1RAB9APOLB
SCHEMBL8937253 1.00 CTNNB1 (0.66) CTNNB1WNT3ANPC1RAB9APOLB
SCHEMBL10455031 0.90 PDE4A (0.57) CTNNB1WNT3ANPC1RAB9APDE4A
SCHEMBL10455030 0.90 PDE4A (0.57) CTNNB1WNT3ANPC1RAB9APDE4A
SCHEMBL5962285 0.89 CA12 (0.65) NPC1PDE4APDE4BPDE4CPDE4D
SCHEMBL8937328 0.88 CTNNB1 (0.57) CTNNB1WNT3ANPC1RAB9APDE4A
SCHEMBL8937325 0.88 CTNNB1 (0.57) CTNNB1WNT3ANPC1RAB9APDE4A
SCHEMBL8937321 0.88 CTNNB1 (0.57) CTNNB1WNT3ANPC1RAB9APDE4A
SCHEMBL9367554 0.88 CA12 (0.62) NPC1PDE4APDE4BPDE4CPDE4D
SCHEMBL8937400 0.88 CTNNB1 (0.55) CTNNB1WNT3ANPC1RAB9APOLB

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-5559109-A Method of treating a PAF-mediated pathology or for treating or preventing psoriasis, nephritis, asthma or shock by administering a PAF antagonist SANKKO COMPANY, LIMITED (JP) 1996-09-24 US disclosed
US-5556852-A PLATELET ACTIVATING FACTOR ANTAGONISTS SANKYO COMPANY, LIMITED (JP) 1996-09-17 US disclosed
EP-0395446-B1 N-acryloylpiperazine derivatives, their preparation and their use as paf antagonists SANKYO CO (JP) 1995-03-01 EP disclosed
US-5369106-A N-acryloylpiperazine derivatives, their preparation and their use of PAF antagonists SANKYO COMPANY, LIMITED (JP) 1994-11-29 US disclosed
US-5192766-A Platelet activating factor antagonist SANKYO COMPANY, LIMITED (JP) 1993-03-09 US disclosed
EP-0395446-A2 N-acryloylpiperazine derivatives, their preparation and their use as paf antagonists Sankyo Company Limited (JP) 1990-10-31 EP disclosed