SCHEMBL3960058

SCHEMBL3960058

CCOC(COc1ccc(C(F)(F)F)cc1)COc1ccc([O])c(C)c1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 18/20 0.67
PPARA Q07869 1/20 0.53
FFAR1 O14842 2/20 0.41
PPARG P37231 1/20 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
SCHEMBL377485 0.86 PPARD (0.72) PPARDPPARA
SCHEMBL377260 0.86 PPARD (0.72) PPARDPPARA
SCHEMBL377494 0.86 PPARD (0.72) PPARDPPARA
SCHEMBL3960064 0.85 PPARD (0.67) PPARDPPARAFFAR1PPARG
SCHEMBL7019114 0.85 PPARD (0.77) PPARDPPARA
SCHEMBL7016586 0.84 PPARD (0.72) PPARDPPARA
SCHEMBL377558 0.80 PPARD (1.00) PPARDPPARA
SCHEMBL13594621 0.79 PPARD (0.69) PPARDPPARA
SCHEMBL14355031 0.79 PPARD (0.72) PPARDPPARA
SCHEMBL7018887 0.79 PPARD (0.81) 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-1667964-B1 4-((PHENOXYALKYL)THIO)-PHENOXYACETIC ACIDS AND ANALOGS JANSSEN PHARMACEUTICA NV (BE) 2009-07-22 EP claimed