SCHEMBL4746649

SCHEMBL4746649

Cc1oc(-c2ccccc2)nc1CCOc1ccc(CN2CCOC[C@H]2C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.63
PPARA Q07869 13/20 0.63
PPARD Q03181 1/20 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
SCHEMBL4744046 1.00 PPARG (0.63) PPARGPPARAPPARD
SCHEMBL4744662 0.94 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL4743963 0.94 PPARG (0.58) PPARGPPARAPPARD
SCHEMBL4744768 0.92 FFAR1 (0.58) PPARGPPARA
SCHEMBL4748448 0.92 FFAR1 (0.58) PPARGPPARA
SCHEMBL4747325 0.91 PPARG (0.58) PPARGPPARA
SCHEMBL4744645 0.91 PPARG (0.58) PPARGPPARA
SCHEMBL4744313 0.90 PPARG (0.53) PPARGPPARA
SCHEMBL4747661 0.90 PPARG (0.53) PPARGPPARA
SCHEMBL4788611 0.88 PPARG (0.49) 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 disclosed