SCHEMBL6952072

SCHEMBL6952072

CCCOC(Cc1ccc(OCCN2CCc3ccccc3C2=O)cc1)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.47
PPARA Q07869 12/20 0.43
PPARD Q03181 2/20 0.41
DRD3 P35462 2/20 0.40
ITGB3 P05106 2/20 0.39
ITGA2B P08514 2/20 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
SCHEMBL6948643 0.94 PPARG (0.55) PPARGPPARAPPARD
SCHEMBL6956717 0.85 PPARG (0.66) PPARGPPARAPPARD
SCHEMBL6948887 0.84 PPARG (0.41) PPARGPPARADRD3ITGB3ITGA2B
SCHEMBL6949400 0.84 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL6954989 0.84 PPARG (0.41) PPARGPPARADRD3ITGB3ITGA2B
SCHEMBL6949408 0.83 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL8300709 0.81 DRD3 (0.41) PPARGPPARADRD3ITGB3ITGA2B
SCHEMBL6956670 0.80 PPARG (0.43) PPARGDRD3
SCHEMBL7040474 0.76 PPARG (0.63) PPARGPPARAPPARD
SCHEMBL8305544 0.74 PPARG (0.51) 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