SCHEMBL6166462

SCHEMBL6166462

Cc1cc(OCc2cc(-c3ccc(C(F)(F)F)cc3)oc2C(F)(F)F)ccc1OC(C)(C)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.60
PPARA Q07869 13/20 0.60
PPARG P37231 6/20 0.50

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
SCHEMBL5860732 0.92 PPARD (0.51) PPARDPPARAPPARG
SCHEMBL5860835 0.92 PPARD (0.61) PPARDPPARAPPARG
SCHEMBL5861093 0.87 PPARD (0.66) PPARDPPARA
SCHEMBL3909220 0.83 PPARD (0.51) PPARDPPARAPPARG
SCHEMBL6162880 0.83 PPARD (0.47) PPARDPPARA
SCHEMBL3906446 0.83 PPARA (0.51) PPARDPPARAPPARG
SCHEMBL5861910 0.82 PPARA (0.47) PPARDPPARA
SCHEMBL5861777 0.82 PPARD (0.50) PPARDPPARAPPARG
SCHEMBL1549715 0.81 PPARD (0.62) PPARDPPARAPPARG
SCHEMBL3912618 0.81 PPARA (0.64) 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 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