SCHEMBL6166217

SCHEMBL6166217

CCC(Oc1ccc(SCc2cc(-c3ccc(C(F)(F)F)cc3)oc2C)cc1C(F)(F)F)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 18/20 0.44
PPARA Q07869 10/20 0.44
PTGDR2 Q9Y5Y4 2/20 0.41
PPARG P37231 3/20 0.41

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
SCHEMBL5861193 0.92 NPC1 (0.38) PPARDPPARAPTGDR2PPARG
SCHEMBL5861817 0.92 PPARD (0.49) PPARDPPARAPTGDR2PPARG
SCHEMBL5861885 0.85 PPARD (0.49) PPARDPPARAPTGDR2PPARG
SCHEMBL5861813 0.84 PPARD (0.58) PPARDPPARAPTGDR2PPARG
SCHEMBL5860603 0.82 PPARD (0.51) PPARDPPARAPTGDR2PPARG
SCHEMBL5861827 0.81 PPARD (0.48) PPARDPPARAPTGDR2PPARG
SCHEMBL5861828 0.81 PPARD (0.49) PPARDPPARAPTGDR2PPARG
SCHEMBL5860825 0.81 PPARD (0.51) PPARDPPARAPTGDR2PPARG
SCHEMBL5860849 0.80 PPARD (0.51) PPARDPPARAPTGDR2PPARG
SCHEMBL5861095 0.80 PPARA (0.50) PPARDPPARAPTGDR2PPARG

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 disclosed