SCHEMBL6956751

SCHEMBL6956751

CCOC(Cc1ccc(CCCN2COc3cc(C)ccc3C2=O)cc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.43
PPARG P37231 16/20 0.43
PPARD Q03181 3/20 0.39

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
SCHEMBL6945038 0.92 PPARA (0.35) PPARAPPARGPPARD
SCHEMBL6953775 0.83 PPARG (0.41) PPARAPPARG
SCHEMBL6955902 0.81 PPARG (0.42) PPARAPPARGPPARD
SCHEMBL6952957 0.81 PPARA (0.41) PPARAPPARGPPARD
SCHEMBL6957490 0.81 PPARG (0.55) PPARAPPARGPPARD
SCHEMBL6951661 0.80 PPARA (0.41) PPARAPPARGPPARD
SCHEMBL6952263 0.76 PPARA (0.42) PPARAPPARG
SCHEMBL7248373 0.75 PPARG (0.62) PPARAPPARGPPARD
SCHEMBL6944881 0.74 PPARG (0.48) PPARAPPARGPPARD
SCHEMBL6957206 0.73 PPARA (0.42) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0903343-B1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP CO LTD (JP) 2003-05-28 EP disclosed
EP-0903343-A1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP Co., Ltd. (JP) 1999-03-24 EP disclosed