SCHEMBL6498670

SCHEMBL6498670

COc1ccc(CC(OC(C)C)C(=O)O)cc1CNC(=O)c1ccc(C(F)(F)F)nc1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.61
PPARA Q07869 20/20 0.61
PPARG P37231 15/20 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
SCHEMBL6502352 0.87 PPARA (0.79) PPARDPPARAPPARG
SCHEMBL6507205 0.83 PPARD (0.75) PPARDPPARAPPARG
SCHEMBL6505358 0.82 PPARA (0.61) PPARDPPARAPPARG
SCHEMBL6496322 0.81 PPARA (0.72) PPARDPPARAPPARG
SCHEMBL6503394 0.81 PPARA (0.60) PPARDPPARAPPARG
SCHEMBL6496595 0.81 PPARA (0.56) PPARDPPARAPPARG
SCHEMBL6505564 0.80 PPARA (0.66) PPARDPPARAPPARG
SCHEMBL6494551 0.80 PPARA (0.64) PPARDPPARAPPARG
SCHEMBL6504171 0.79 PPARA (0.58) PPARDPPARAPPARG
SCHEMBL6495734 0.79 PPARA (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed