SCHEMBL6507587

SCHEMBL6507587

CCC(Cc1ccc(OC)c(CNC(=O)c2ccc(OC)cc2OC)c1)C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.74
PPARD Q03181 16/20 0.71
PPARG P37231 13/20 0.69

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
SCHEMBL6506011 0.89 PPARA (0.76) PPARAPPARDPPARG
SCHEMBL6498633 0.86 PPARA (0.86) PPARAPPARDPPARG
SCHEMBL27499084 0.85 PPARA (0.80) PPARAPPARDPPARG
SCHEMBL6503654 0.84 ALDH1A1 (0.57) PPARAPPARDPPARG
SCHEMBL6528079 0.83 PPARA (0.70) PPARAPPARDPPARG
SCHEMBL3945192 0.82 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL23752211 0.81 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL18644833 0.81 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL3945781 0.81 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL6505382 0.80 PPARA (0.81) 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 3 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
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