SCHEMBL7832791

SCHEMBL7832791

CS(=O)(=O)c1ccc(-c2sc(COCc3ccc4ccccc4n3)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 3/20 0.60

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
SCHEMBL7840958 1.00 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL7844193 0.91 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL7842885 0.91 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL7832794 0.87 PDE10A (0.46) PTGS2PTGS1
SCHEMBL7840962 0.87 PTGS2 (0.45) PTGS2PTGS1
SCHEMBL7840985 0.85 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL7844212 0.85 PTGS2 (0.76) PTGS2PTGS1
SCHEMBL7841803 0.84 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL7832907 0.84 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL7846131 0.79 PTGS2 (0.76) 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