SCHEMBL13433441

SCHEMBL13433441

CCCOc1ccc(-c2cccc(CC(=O)O)c2)cc1CNC(=O)c1ccc(Cl)cc1F

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 15/20 0.56
PPARA Q07869 11/20 0.56
PPARG P37231 8/20 0.49
PTPN11 Q06124 1/20 0.48

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
SCHEMBL13433439 0.91 PTPN11 (0.50) PPARDPPARAPPARGPTPN11
SCHEMBL13433429 0.89 PPARD (0.47) PPARDPPARAPPARG
SCHEMBL13433442 0.88 PPARD (0.72) PPARDPPARAPPARG
SCHEMBL3413388 0.88 PPARD (0.72) PPARDPPARAPPARGPTPN11
SCHEMBL3419318 0.86 PPARD (0.62) PPARDPPARAPPARG
SCHEMBL13433443 0.85 PTPN11 (0.49) PPARDPPARAPPARGPTPN11
SCHEMBL13460797 0.85 PPARD (0.55) PPARDPPARAPPARG
SCHEMBL3419425 0.83 PPARD (0.71) PPARDPPARAPPARG
SCHEMBL3414033 0.83 PPARD (0.62) PPARDPPARAPPARG
SCHEMBL13433449 0.82 PPARG (0.47) PPARDPPARAPPARGPTPN11

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-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
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