SCHEMBL8937320

SCHEMBL8937320

CCc1ccc(/C(=C/C(=O)O)c2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TSHR P16473 1/20 0.46
S1PR3 Q99500 1/20 0.46
PGR P06401 1/20 0.44
EPHX2 P34913 1/20 0.43
KMO O15229 1/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.42

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
SCHEMBL8937323 1.00 PDPK1 (0.47) PDPK1ALDH1A1TSHRS1PR3PGR
SCHEMBL8937317 1.00 PDPK1 (0.47) PDPK1ALDH1A1TSHRS1PR3PGR
SCHEMBL8937228 0.84 GAA (0.54) PDPK1ALDH1A1S1PR3GAAMAPT
SCHEMBL8937226 0.84 GAA (0.54) PDPK1ALDH1A1S1PR3GAAMAPT
SCHEMBL8937230 0.84 GAA (0.54) PDPK1ALDH1A1S1PR3GAAMAPT
SCHEMBL8937429 0.83 S1PR3 (0.47) PDPK1ALDH1A1S1PR3GAAMAPT
SCHEMBL8937426 0.83 S1PR3 (0.47) PDPK1ALDH1A1S1PR3GAAMAPT
SCHEMBL8937432 0.83 S1PR3 (0.47) PDPK1ALDH1A1S1PR3GAAMAPT
SCHEMBL17802357 0.83 TSHR (0.53) PDPK1TSHRKMO
SCHEMBL17802354 0.83 TSHR (0.53) PDPK1TSHRKMO

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