SCHEMBL6498702

SCHEMBL6498702

CCCOC(Cc1ccc(OC)c(CNC(=O)c2nc(-c3ccccc3)sc2C)c1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.52
PPARA Q07869 14/20 0.52
PPARD Q03181 11/20 0.52

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
SCHEMBL7684941 0.94 PPARA (0.52) PPARGPPARAPPARD
SCHEMBL6494086 0.93 PPARA (0.54) PPARGPPARAPPARD
SCHEMBL6498475 0.91 PPARA (0.46) PPARGPPARAPPARD
SCHEMBL6497873 0.90 PPARA (0.50) PPARGPPARAPPARD
SCHEMBL6497310 0.85 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL6498088 0.82 PPARA (0.47) PPARGPPARAPPARD
SCHEMBL6502624 0.82 PPARG (0.46) PPARGPPARAPPARD
SCHEMBL6498320 0.82 PPARA (0.45) PPARGPPARAPPARD
SCHEMBL6504835 0.81 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL6527212 0.81 PPARA (0.45) PPARGPPARAPPARD

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