SCHEMBL7843974

SCHEMBL7843974

NS(=O)(=O)c1ccc(-c2sc(S(=O)(=O)Cc3cccc(F)c3)nc2-c2ccc(F)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 19/20 0.52
PTGS1 P23219 8/20 0.52
NTRK1 P04629 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
SCHEMBL7847497 1.00 PTGS2 (0.52) PTGS2PTGS1NTRK1
SCHEMBL7842501 0.92 PTGS2 (0.52) PTGS2PTGS1
SCHEMBL7834092 0.92 PTGS2 (0.52) PTGS2PTGS1
SCHEMBL7840420 0.91 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL7847298 0.91 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL7841403 0.90 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL7832343 0.90 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL7833479 0.90 PTGS2 (0.52) PTGS2PTGS1
SCHEMBL7842546 0.90 PTGS2 (0.52) PTGS2PTGS1
SCHEMBL7846136 0.90 PTGS2 (0.61) 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 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