SCHEMBL4748448

SCHEMBL4748448

Cc1oc(-c2ccccc2)nc1COc1ccc(CN2CCOC[C@H]2C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.58
PPARG P37231 14/20 0.57
PPARA Q07869 11/20 0.57
CD274 Q9NZQ7 2/20 0.52
MAOB P27338 1/20 0.50
KDR P35968 1/20 0.48

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
SCHEMBL4744768 1.00 FFAR1 (0.58) FFAR1PPARGPPARACD274MAOB
SCHEMBL4744410 0.94 PPARG (0.58) FFAR1PPARGPPARAMAOB
SCHEMBL4748439 0.94 PPARG (0.58) FFAR1PPARGPPARAMAOB
SCHEMBL4746249 0.92 FFAR1 (0.55) FFAR1PPARGPPARAMAOBKDR
SCHEMBL4744046 0.92 PPARG (0.63) PPARGPPARA
SCHEMBL4746649 0.92 PPARG (0.63) PPARGPPARA
SCHEMBL4748435 0.91 KDR (0.59) FFAR1PPARGPPARACD274KDR
SCHEMBL4747572 0.91 KDR (0.59) FFAR1PPARGPPARACD274KDR
SCHEMBL4743673 0.90 PPARG (0.49) FFAR1PPARGPPARAMAOB
SCHEMBL4748410 0.90 PPARG (0.49) FFAR1PPARGPPARAMAOB

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