SCHEMBL8792575

SCHEMBL8792575

CS(=O)(=O)c1ccc(-c2nsnc2SC#N)cc1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 12/20 0.41
IKBKB O14920 1/20 0.38
CHUK O15111 1/20 0.38
PTGS1 P23219 2/20 0.37
MYC P01106 1/20 0.37
WDR5 P61964 1/20 0.37

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
SCHEMBL8788632 0.83 PTGS2 (0.39) PTGS2IKBKBCHUKPTGS1
SCHEMBL8789881 0.77 MYC (0.50) MYCWDR5
SCHEMBL8789362 0.77 ERBB2 (0.40) MYCWDR5
SCHEMBL8790492 0.74 MYC (0.53) MYCWDR5
SCHEMBL19450642 0.72 PTGS2 (0.43) PTGS2PTGS1
SCHEMBL19434380 0.72 PTGS2 (0.46) PTGS2PTGS1
SCHEMBL15221164 0.69 CA2 (0.66) PTGS2
SCHEMBL8789377 0.68 IDO1 (0.42)
SCHEMBL27659883 0.65 CHUK (0.53) PTGS2IKBKBCHUKPTGS1
SCHEMBL16979041 0.64 IKBKB (0.49) PTGS2IKBKBCHUKPTGS1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0799216-A1 SUBSTITUTED THIADIAZOLES, COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTIMICROBIAL AND MARINE ANTIFOULING AGENTS THE DOW CHEMICAL COMPANY (US) 1997-10-08 EP disclosed
WO-1996019467-A1 SUBSTITUTED THIADIAZOLES, COMPOSITIONS CONTAINING THEM AND THEIR USE AS ANTIMICROBIAL AND MARINE ANTIFOULING AGENTS THE DOW CHEMICAL COMPANY (US) 1996-06-27 WO disclosed
US-5488060-A Substituted thiadiazoles, compositions containing them and their use as antimicrobial and marine antifouling agents THE DOW CHEMICAL COMPANY (US) 1996-01-30 US disclosed