SCHEMBL6496409

SCHEMBL6496409

CCC(Cc1ccc(OC)c(CNC(=O)c2ccc3ncccc3c2)c1)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.70
PPARD Q03181 19/20 0.70
PPARG P37231 15/20 0.68

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
SCHEMBL6505382 0.87 PPARA (0.81) PPARAPPARDPPARG
SCHEMBL3945192 0.80 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL5362876 0.79 PPARA (0.83) PPARAPPARDPPARG
SCHEMBL6496768 0.79 PPARA (0.71) PPARAPPARDPPARG
SCHEMBL13491550 0.79 USP2 (0.60)
SCHEMBL3943372 0.79 PPARD (1.00) PPARAPPARDPPARG
SCHEMBL13491629 0.77 ALOX15 (0.53)
SCHEMBL6506063 0.77 PPARA (0.63) PPARAPPARDPPARG
SCHEMBL3945781 0.76 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL6506011 0.76 PPARA (0.76) PPARAPPARDPPARG

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