SCHEMBL8302577

SCHEMBL8302577

CCC1=C(C)CN(CCOc2ccc(CC(OC)C(N)=O)cc2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.41
PPARA Q07869 14/20 0.41
PPARD Q03181 6/20 0.41
DRD3 P35462 2/20 0.36
DRD2 P14416 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
SCHEMBL8306803 0.91 PPARG (0.52) PPARGPPARAPPARDDRD3
SCHEMBL8304445 0.90 PPARA (0.42) PPARGPPARAPPARD
SCHEMBL8301343 0.83 HRH3 (0.39) PPARG
SCHEMBL8446636 0.80 PPARG (0.38) PPARGPPARAPPARD
SCHEMBL8307026 0.78 ITGB1 (0.41) PPARGPPARA
SCHEMBL8306723 0.77 PARP1 (0.36) PPARGPPARA
SCHEMBL6955247 0.75 MAPT (0.44) PPARGPPARAPPARD
SCHEMBL6948555 0.75 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL8306160 0.72 PPARG (0.46) PPARGPPARAPPARD
SCHEMBL7111403 0.72 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 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