SCHEMBL13460810

SCHEMBL13460810

COc1ccc(-c2cccc(CCC=O)c2)cc1CNC(=O)c1ccc(C(F)(F)F)cc1F

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 19/20 0.57
▸ PPARA Q07869 16/20 0.57
▸ PPARG P37231 7/20 0.56

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
SCHEMBL3415748 0.89 PPARD (0.62) PPARDPPARAPPARG
SCHEMBL13433432 0.87 PPARD (0.62) PPARDPPARAPPARG
SCHEMBL13460768 0.86 PPARD (0.61) PPARDPPARAPPARG
SCHEMBL13460964 0.85 PPARD (0.64) PPARDPPARAPPARG
SCHEMBL3415075 0.83 PPARD (0.79) PPARDPPARAPPARG
SCHEMBL13460807 0.83 PPARD (0.57) PPARDPPARAPPARG
SCHEMBL13460824 0.83 PPARD (0.60) PPARDPPARAPPARG
SCHEMBL3418675 0.83 PPARA (0.83) PPARDPPARAPPARG
SCHEMBL13460822 0.82 PPARD (0.59) PPARDPPARAPPARG
SCHEMBL13460809 0.82 PPARD (0.58) 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
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 — — US disclosed
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