SCHEMBL6955136

SCHEMBL6955136

CCOC(Cc1ccc(OCCN2CN(c3ccccc3)c3ccc(C)cc3C2=O)cc1)C(=O)OC

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.47
PPARA Q07869 18/20 0.47
PPARD Q03181 2/20 0.43

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
SCHEMBL6956130 0.91 PPARG (0.46) PPARGPPARAPPARD
SCHEMBL6947127 0.81 ALDH1A1 (0.40) PPARGPPARAPPARD
SCHEMBL6947132 0.81 ALDH1A1 (0.41) PPARGPPARAPPARD
SCHEMBL6947471 0.80 PPARG (0.45) PPARGPPARAPPARD
SCHEMBL6949400 0.76 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL6955247 0.74 MAPT (0.44) PPARGPPARAPPARD
SCHEMBL8796714 0.73 ALDH1A1 (0.41) PPARG
SCHEMBL7034640 0.72 PPARG (0.56) PPARGPPARAPPARD
SCHEMBL7107208 0.71 PPARG (0.62) PPARGPPARAPPARD
SCHEMBL7248494 0.71 PPARG (0.52) 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
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