SCHEMBL7842019

SCHEMBL7842019

CS(=O)(=O)c1ccccc1-c1sc(C(=O)Nc2ccccc2)nc1-c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 3/20 0.46
PTGS2 P35354 11/20 0.45
BCAT2 O15382 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
ALOX5 P09917 1/20 0.44
PKM P14618 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 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 0.97 PTGS2 (0.46) ATRNPC1RAB9AMAPTPTGS2
SCHEMBL7833108 0.93 MAPT (0.46) ATRNPC1RAB9AMAPTPTGS2
SCHEMBL7841026 0.92 ESRRG (0.48) ATRNPC1RAB9AMAPTPTGS2
SCHEMBL7845667 0.92 PTGS2 (0.46) RAB9AMAPTPTGS2MEN1KMT2A
SCHEMBL7841887 0.92 PTGS2 (0.43) ATRNPC1RAB9AMAPTPTGS2
SCHEMBL7844026 0.92 NPSR1 (0.45) ATRMAPTPTGS2ALOX5
SCHEMBL7842353 0.92 NPC1 (0.48) ATRNPC1RAB9AMAPTPTGS2
SCHEMBL7842821 0.90 GRM5 (0.43) ATRNPC1RAB9AMAPTPTGS2
SCHEMBL7842580 0.90 PTGS2 (0.43) RAB9AMAPTPTGS2SMN1; SMN2MEN1
SCHEMBL7844350 0.89 PTGS2 (0.45) PTGS2SMN1; SMN2MEN1KMT2AKDM4E

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
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
EP-0772606-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
WO-1996003392-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO disclosed