SCHEMBL4747144

SCHEMBL4747144

Cc1ccc(-c2nc(CCOc3cccc(CN4CCCCC4C(=O)O)c3)c(C)o2)cc1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.54
PPARG P37231 18/20 0.54
CD274 Q9NZQ7 1/20 0.54

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 0.95 PPARG (0.60) PPARAPPARGCD274
SCHEMBL4880332 0.94 PPARA (0.56) PPARAPPARG
SCHEMBL4787963 0.94 PPARA (0.56) PPARAPPARG
SCHEMBL4785953 0.93 CD274 (0.55) PPARAPPARGCD274
SCHEMBL4746305 0.93 PPARG (0.58) PPARAPPARG
SCHEMBL4746302 0.93 PPARG (0.58) PPARAPPARG
SCHEMBL4748226 0.91 POLB (0.59) PPARAPPARG
SCHEMBL4748070 0.90 CD274 (0.55) PPARAPPARGCD274
SCHEMBL4748063 0.90 CD274 (0.55) PPARAPPARGCD274
SCHEMBL4748003 0.90 CD274 (0.55) PPARAPPARGCD274

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