SCHEMBL6165286

SCHEMBL6165286

Cc1cc(SCc2ccc(-c3ccc(C(F)(F)F)cc3)o2)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 17/20 0.46
PPARA Q07869 10/20 0.46
PPARG P37231 4/20 0.43
PRMT1 Q99873 1/20 0.41
ALOX5 P09917 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
AR P10275 1/20 0.36

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
SCHEMBL6165278 0.86 PPARD (0.46) PPARDPPARAPPARGPRMT1
SCHEMBL6165395 0.84 PPARD (0.47) PPARDPPARAPPARGAR
SCHEMBL6167079 0.83 PPARD (0.45) PPARDPPARAPPARGAR
SCHEMBL5860868 0.81 PPARD (0.72) PPARDPPARAPPARG
SCHEMBL8192106 0.80 PPARD (0.56) PPARDPPARAPPARGAR
SCHEMBL13224731 0.80 PPARD (0.69) PPARDPPARAPPARG
SCHEMBL5860745 0.79 PPARD (0.53) PPARDPPARAPPARG
SCHEMBL6167419 0.78 PPARD (0.46) PPARDPPARAPPARG
SCHEMBL6167231 0.78 PPARD (0.47) PPARDPPARAPPARGAR
SCHEMBL6163713 0.78 PPARD (0.44) PPARDPPARAPPARGAR

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-1392674-B1 FURAN AND THIOPHENE DERIVATIVES THAT ACTIVATE HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS SMITHKLINE BEECHAM CORP (US) 2005-08-10 EP claimed