SCHEMBL4785953

SCHEMBL4785953

Cc1cccc(-c2nc(CCOc3cccc(CN4CCCCC4C(=O)O)c3)c(C)o2)c1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 1/20 0.55
PPARG P37231 19/20 0.55
PPARA Q07869 19/20 0.55

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
SCHEMBL4747524 0.94 PPARG (0.60) CD274PPARGPPARA
SCHEMBL4747144 0.93 PPARA (0.54) CD274PPARGPPARA
SCHEMBL4746302 0.90 PPARG (0.58) PPARGPPARA
SCHEMBL4746305 0.90 PPARG (0.58) PPARGPPARA
SCHEMBL4787429 0.87 CD274 (0.57) CD274PPARGPPARA
SCHEMBL4747748 0.87 CD274 (0.57) CD274PPARGPPARA
SCHEMBL4743927 0.87 CD274 (0.65) CD274PPARGPPARA
SCHEMBL4744001 0.87 CD274 (0.65) CD274PPARGPPARA
SCHEMBL4880332 0.87 PPARA (0.56) PPARGPPARA
SCHEMBL4787963 0.87 PPARA (0.56) PPARGPPARA

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
WO-2008117982-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR INHIBITING LIPID ACCUMULATION CONTAINING SAME CRYSTAL GENOMICS, INC. (KR) 2008-10-02 WO claimed