SCHEMBL8985285

SCHEMBL8985285

CNC(=O)c1cc(-c2ccc(NS(C)(=O)=O)cc2)c(-c2ccc(F)cc2)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.52
PTGS1 P23219 4/20 0.52
MAPK14 Q16539 5/20 0.49
KDM4E B2RXH2 3/20 0.46
HPGD P15428 3/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
RAB9A P51151 1/20 0.46
HSD17B10 Q99714 2/20 0.44
MT-CO1 P00395 1/20 0.44
MT-CO2 P00403 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
PLK1 P53350 1/20 0.42
IKBKB O14920 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
SCHEMBL8985442 0.88 MAPK14 (0.64) PTGS2PTGS1MAPK14KDM4EHPGD
SCHEMBL8985191 0.88 MAPK14 (0.60) PTGS2PTGS1MAPK14KDM4EHPGD
SCHEMBL8985287 0.87 PTGS2 (0.56) PTGS2PTGS1MAPK14KDM4EHPGD
SCHEMBL8985386 0.86 PTGS2 (0.63) PTGS2PTGS1MAPK14KDM4EHPGD
SCHEMBL8985502 0.85 PTGS2 (0.51) PTGS2PTGS1MAPK14KDM4EHPGD
SCHEMBL8985206 0.82 MAPK14 (0.54) PTGS2PTGS1MAPK14KDM4EHPGD
SCHEMBL8985371 0.81 PTGS2 (0.57) PTGS2PTGS1MAPK14KDM4EHPGD
SCHEMBL8985425 0.80 MAPK14 (0.52) PTGS2PTGS1MAPK14KDM4EHPGD
SCHEMBL8985326 0.80 MAPK14 (0.52) PTGS2PTGS1MAPK14KDM4EHPGD
SCHEMBL8985276 0.80 OPRD1 (0.66) PTGS2PTGS1MAPK14KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5571810-A ANTIINFLAMMATORY AGENTS, ANALGESICS, COLLAGEN DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-05 US disclosed
EP-0593761-A1 NEW THIOPHENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-04-27 EP disclosed
CN-1059142-A New thiophene derivant FUJISAWA PHARMACEUTICAL CO (JP) 1992-03-04 CN disclosed
WO-1991019708-A1 NEW THIOPHENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-12-26 WO disclosed