SCHEMBL7845667

SCHEMBL7845667

CS(=O)(=O)c1ccccc1-c1sc(C(=O)Nc2ccc(Cl)cc2)nc1-c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.46
F10 P00742 5/20 0.45
MAPT P10636 2/20 0.42
APAF1 O14727 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
CNR1 P21554 1/20 0.41
ALOX5 P09917 1/20 0.41
FPR1 P21462 1/20 0.41
FPR2 P25090 1/20 0.41
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL7846162 0.95 PTGS2 (0.46) PTGS2F10MAPTMEN1CYP1A2
SCHEMBL7842757 0.92 PTGS2 (0.46) PTGS2F10MAPTAPAF1MAPK1
SCHEMBL7842019 0.92 ATR (0.46) PTGS2MAPTMEN1CYP1A2CYP2C19
SCHEMBL7844350 0.91 PTGS2 (0.45) PTGS2F10MEN1KMT2AALOX5
SCHEMBL7833108 0.91 MAPT (0.46) PTGS2F10MAPTMEN1KMT2A
SCHEMBL7841887 0.90 PTGS2 (0.43) PTGS2F10MAPTMEN1KMT2A
SCHEMBL7842580 0.90 PTGS2 (0.43) PTGS2F10MAPTMEN1KMT2A
SCHEMBL7844026 0.88 NPSR1 (0.45) PTGS2F10MAPTALOX5
SCHEMBL7841016 0.87 PTGS2 (0.46) PTGS2MAPTMEN1KMT2AALOX5
SCHEMBL7841026 0.86 ESRRG (0.48) PTGS2MAPTMAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1125932-A2 Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 2001-08-22 EP disclosed
US-5668161-A Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 1997-09-16 US disclosed