SCHEMBL4744571

SCHEMBL4744571

Cc1oc(-c2cccs2)nc1CCOc1cccc(COC(=O)C2CCCCN2)c1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.49
PPARG P37231 18/20 0.49
PPARD Q03181 3/20 0.49

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
SCHEMBL4747104 0.94 PPARA (0.48) PPARAPPARGPPARD
SCHEMBL4743967 0.92 PPARA (0.49) PPARAPPARGPPARD
SCHEMBL4748098 0.87 PPARA (0.52) PPARAPPARG
SCHEMBL4743931 0.81 KDR (0.61) PPARAPPARG
SCHEMBL4393607 0.80 PPARG (0.61) PPARAPPARGPPARD
SCHEMBL4746620 0.80 PPARA (0.55) PPARAPPARG
SCHEMBL4744629 0.79 KDR (0.62) PPARAPPARG
SCHEMBL4401552 0.78 PPARG (0.57) PPARAPPARGPPARD
SCHEMBL4746216 0.78 POLB (0.57) PPARAPPARGPPARD
SCHEMBL4748548 0.78 PPARG (0.55) PPARAPPARG

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 claimed
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