SCHEMBL6185567

SCHEMBL6185567

Cc1cc(SCc2nc(-c3ccc(C(F)(F)F)cc3)sc2C)ccc1OCC(=O)O

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.77
PPARA Q07869 11/20 0.77
PPARG P37231 3/20 0.77

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
SCHEMBL30460470 1.00 PPARD (0.77) PPARDPPARAPPARG
SCHEMBL5509241 0.89 PPARD (0.79) PPARDPPARAPPARG
SCHEMBL5517495 0.88 PPARD (0.82) PPARDPPARAPPARG
SCHEMBL4801459 0.88 PPARD (0.82) PPARDPPARAPPARG
SCHEMBL5514857 0.87 PPARD (0.77) PPARDPPARAPPARG
Gw501516 SCHEMBL29356729 0.87 PPARD (1.00) PPARDPPARAPPARG
Gw501516 SCHEMBL68714 0.87 PPARD (1.00) PPARDPPARAPPARG
SCHEMBL5512333 0.87 PPARD (0.79) PPARDPPARAPPARG
SCHEMBL4803419 0.87 PPARD (0.82) PPARDPPARAPPARG
SCHEMBL5519969 0.86 PPARD (0.98) PPARDPPARAPPARG

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
CN-109897013-B Preparation method of selective PPAR delta agonist GW501516 无锡科华生物科技有限公司 2023-04-07 CN disclosed
EP-1349843-B1 THIAZOLE AND OXAZOLE DERIVATIVES AS ACTIVATORS OF HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS SMITHKLINE BEECHAM CORP (US) 2005-04-20 EP disclosed