SCHEMBL7840792

SCHEMBL7840792

CS(=O)(=O)c1ccc(-c2sc(COc3cccc(Cl)c3)nc2-c2ccccc2F)cc1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 16/20 0.57
PTGS1 P23219 3/20 0.53
PPARD Q03181 3/20 0.43
MAPT P10636 1/20 0.42
RAB9A P51151 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
SCHEMBL7844744 0.91 PTGS2 (0.65) PTGS2PTGS1PPARDMAPTRAB9A
SCHEMBL7842012 0.88 PTGS2 (0.68) PTGS2PTGS1
SCHEMBL6442569 0.88 PTGS2 (0.68) PTGS2PTGS1
SCHEMBL7843368 0.87 PTGS2 (0.42) PTGS2PTGS1PPARDMAPTRAB9A
SCHEMBL7844228 0.86 PTGS2 (0.57) PTGS2PTGS1PPARD
SCHEMBL7842015 0.85 PTGS2 (0.55) PTGS2PTGS1PPARDMAPTRAB9A
SCHEMBL7847194 0.85 PTGS2 (0.44) PTGS2PTGS1PPARDMAPTRAB9A
SCHEMBL8797070 0.84 PTGS2 (0.66) PTGS2PTGS1
SCHEMBL7846788 0.84 PTGS2 (0.55) PTGS2PTGS1PPARDMAPTRAB9A
SCHEMBL7843634 0.80 PTGS2 (0.55) PTGS2PTGS1PPARDRAB9A

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