SCHEMBL8302884

SCHEMBL8302884

CCOC(Cc1ccc(OCCN2CCN(C)CCC2=O)cc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.62
PPARA Q07869 18/20 0.58
PPARD Q03181 3/20 0.57

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
SCHEMBL8307977 0.91 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL8305544 0.91 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL8300947 0.88 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL8304487 0.85 PPARG (0.48) PPARGPPARAPPARD
SCHEMBL8306153 0.83 NPC1 (0.46) PPARGPPARA
SCHEMBL8308030 0.83 ITGB3 (0.48) PPARGPPARA
SCHEMBL6956717 0.81 PPARG (0.66) PPARGPPARAPPARD
SCHEMBL8301593 0.80 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL7035857 0.79 PPARG (0.75) PPARGPPARAPPARD
SCHEMBL27674855 0.78 PPARA (0.81) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

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