SCHEMBL7846441

SCHEMBL7846441

CS(=O)(=O)c1ccc(-c2sc(S(=O)(=O)c3cccc(F)c3)nc2-c2ccc(F)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.61
PTGS1 P23219 2/20 0.58

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
SCHEMBL7844851 1.00 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL7833625 0.91 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL7841716 0.91 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL7841584 0.90 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL7840175 0.90 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL7845660 0.90 PTGS2 (0.70) PTGS2PTGS1
SCHEMBL7846030 0.90 PTGS2 (0.70) PTGS2PTGS1
SCHEMBL7840992 0.90 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL7843099 0.90 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL7846488 0.89 PTGS2 (0.71) PTGS2PTGS1

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 5 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
EP-0770613-A1 Substituted Imidazolidin-2,4-dione der4ivatives as immunomodulators Grünenthal GmbH (DE) 1997-05-02 EP disclosed
WO-1996003392-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO disclosed