SCHEMBL6498729

SCHEMBL6498729

CCCCc1ccc(C(=O)NCc2cc(CC(CC)C(=O)O)ccc2OC)nc1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.64
PPARD Q03181 17/20 0.64
PPARG P37231 16/20 0.62

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
SCHEMBL7680533 0.87 PPARA (0.47) PPARAPPARDPPARG
SCHEMBL6505110 0.84 PPARA (0.68) PPARAPPARDPPARG
SCHEMBL6506063 0.82 PPARA (0.63) PPARAPPARDPPARG
SCHEMBL6505769 0.79 PPARA (0.65) PPARAPPARDPPARG
SCHEMBL6496768 0.79 PPARA (0.71) PPARAPPARDPPARG
SCHEMBL6498726 0.79 PPARA (0.46) PPARAPPARDPPARG
SCHEMBL6506011 0.78 PPARA (0.76) PPARAPPARDPPARG
SCHEMBL6527076 0.77 PPARG (0.49) PPARAPPARDPPARG
SCHEMBL4459430 0.76 PPARA (0.69) PPARAPPARDPPARG
SCHEMBL6507587 0.75 PPARA (0.74) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1228327-C Carboxylic acid derivatives and drugs containing the same EISAI CO LTD (JP) 2005-11-23 CN disclosed
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
CN-1377336-A Carboxylic acid derivatives and drugs containing the same EISAI CO LTD (JP) 2002-10-30 CN disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed