SCHEMBL6950469

SCHEMBL6950469

COC(Cc1ccc(CCCN2CCc3ccccc3C2=O)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 12/20 0.46
DRD2 P14416 4/20 0.46
DRD4 P21917 1/20 0.46
DRD1 P21728 5/20 0.46
PPARG P37231 4/20 0.43
PPARA Q07869 4/20 0.43
PPARD Q03181 3/20 0.43
ACHE P22303 1/20 0.42
GRM5 P41594 1/20 0.42

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
SCHEMBL6956670 0.83 PPARG (0.43) DRD3DRD2DRD4DRD1PPARG
SCHEMBL6950699 0.81 PPARG (0.41) DRD3DRD2DRD4DRD1PPARG
SCHEMBL6956717 0.77 PPARG (0.66) PPARGPPARAPPARD
SCHEMBL7530470 0.76 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL7527592 0.76 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL8550212 0.72 DRD3 (0.55) DRD3DRD2DRD4DRD1GRM5
SCHEMBL6949400 0.71 PPARG (0.54) PPARGPPARAPPARD
SCHEMBL7530431 0.71 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL31134854 0.71 GRM5 (0.64) DRD3DRD2DRD4DRD1ACHE
SCHEMBL5811132 0.71 GRM5 (0.64) DRD3DRD2DRD4DRD1ACHE

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