SCHEMBL6242514

SCHEMBL6242514

Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1COc1ccc[c]c1F

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 16/20 0.54
PPARA Q07869 11/20 0.54
PPARG P37231 8/20 0.54
FFAR1 O14842 8/20 0.53
CHRM5 P08912 1/20 0.45
SLC6A3 Q01959 1/20 0.45

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
SCHEMBL6239400 0.89 PPARD (0.54) PPARDPPARAPPARGFFAR1CHRM5
SCHEMBL6500900 0.77 PPARD (0.52) PPARDPPARAPPARGFFAR1CHRM5
SCHEMBL15160329 0.76 PPARD (0.61) PPARDPPARAPPARGFFAR1
SCHEMBL5016708 0.76 PPARD (0.52) PPARDPPARAPPARGFFAR1
SCHEMBL6237739 0.76 PPARD (0.56) PPARDPPARAPPARGFFAR1CHRM5
SCHEMBL6263799 0.75 PPARD (0.59) PPARDPPARAPPARGFFAR1
SCHEMBL4677332 0.74 PPARD (0.56) PPARDPPARAPPARGFFAR1
SCHEMBL15158746 0.74 PPARD (0.58) PPARDPPARAPPARGFFAR1
SCHEMBL3370111 0.73 PPARD (0.54) PPARDPPARAPPARGFFAR1
SCHEMBL5850218 0.73 PPARD (0.58) PPARDPPARAPPARGFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189895-B1 THIAZOLE AND OXAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE SMITHKLINE BEECHAM CORP (US) 2005-06-08 EP claimed