SCHEMBL6948917

SCHEMBL6948917

CCNC(Cc1ccc(OCCN2COc3ccccc3C2=O)cc1)C(=O)OCC

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.40
PPARA Q07869 7/20 0.40
BACE1 P56817 1/20 0.39
PPARD Q03181 1/20 0.38
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
ELANE P08246 1/20 0.36
LTA4H P09960 1/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL6954155 0.91 PPARG (0.43) PPARGPPARAPPARDITGB3ITGA2B
Hydrochloric Acid SCHEMBL6944979 0.86 PPARG (0.41) PPARGPPARAPPARDLTA4HHPGD
SCHEMBL7248494 0.86 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL7248373 0.81 PPARG (0.62) PPARGPPARAPPARD
SCHEMBL6955086 0.80 PPARG (0.36) PPARGPPARAITGB3ITGA2B
SCHEMBL6956385 0.80 PPARG (0.42) PPARGPPARAPPARD
SCHEMBL6952576 0.79 PPARG (0.45) PPARGPPARAPPARD
SCHEMBL6952568 0.78 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL6948555 0.78 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL6955185 0.77 LTA4H (0.37) PPARGPPARALTA4HHPGDNPSR1

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