SCHEMBL6506063

SCHEMBL6506063

CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(-c3ncccc3OC)cn2)c1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.63
PPARD Q03181 15/20 0.63
PPARG P37231 15/20 0.63

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
SCHEMBL6498729 0.82 PPARA (0.64) PPARAPPARDPPARG
SCHEMBL6505110 0.81 PPARA (0.68) PPARAPPARDPPARG
SCHEMBL6496768 0.77 PPARA (0.71) PPARAPPARDPPARG
SCHEMBL6496409 0.77 PPARA (0.70) PPARAPPARDPPARG
SCHEMBL6505769 0.76 PPARA (0.65) PPARAPPARDPPARG
SCHEMBL6506069 0.75 PPARA (0.61) PPARAPPARDPPARG
SCHEMBL14083035 0.74 POLB (0.58)
SCHEMBL6506011 0.74 PPARA (0.76) PPARAPPARDPPARG
SCHEMBL5362876 0.74 PPARA (0.83) PPARAPPARDPPARG
SCHEMBL14083042 0.73 HCRTR1 (0.58)

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