SCHEMBL4337033

SCHEMBL4337033

Cc1ccc(OCC(O)COc2ccc(CC(OC(C)C)C(=O)O)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.58
PPARG P37231 18/20 0.58
PPARD Q03181 11/20 0.58

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
SCHEMBL4334094 0.89 PPARA (0.59) PPARAPPARGPPARD
SCHEMBL4334569 0.88 PPARG (0.48) PPARAPPARGPPARD
SCHEMBL4334574 0.88 PPARG (0.48) PPARAPPARGPPARD
SCHEMBL4335005 0.88 PPARG (0.56) PPARAPPARGPPARD
SCHEMBL4334564 0.88 PPARG (0.48) PPARAPPARGPPARD
SCHEMBL4334186 0.88 PPARA (0.48) PPARAPPARGPPARD
SCHEMBL4338121 0.86 PPARG (0.60) PPARAPPARGPPARD
SCHEMBL4339632 0.84 PPARG (0.54) PPARAPPARGPPARD
SCHEMBL4339633 0.83 PPARG (0.55) PPARAPPARGPPARD
SCHEMBL4332162 0.83 PPARA (0.50) PPARAPPARGPPARD

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
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
EP-1380562-A1 CARBOXYLIC ACID DERIVATIVE AND SALT THEREOF Eisai Co., Ltd. (JP) 2004-01-14 EP disclosed