SCHEMBL4738676

SCHEMBL4738676

COc1cc(CCCCCOc2nc3ccccc3cc2C(O)CC#CCCCC(=O)O)cc(OC)c1OC

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 11/20 0.63
PPARG P37231 10/20 0.63
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CYSLTR2 Q9NS75 2/20 0.37
CYSLTR1 Q9Y271 2/20 0.37

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
SCHEMBL4736308 0.90 PPARA (0.65) PPARAPPARGCYSLTR2CYSLTR1
SCHEMBL4738651 0.89 PPARA (0.68) PPARAPPARGCYSLTR2CYSLTR1
SCHEMBL4739535 0.89 PPARA (0.65) PPARAPPARGCYSLTR2CYSLTR1
SCHEMBL4738592 0.86 PPARA (0.68) PPARAPPARGMEN1KMT2ACYSLTR2
SCHEMBL4740467 0.85 PPARA (0.63) PPARAPPARGCYSLTR2CYSLTR1
SCHEMBL4740472 0.85 PPARA (0.63) PPARAPPARGCYSLTR2CYSLTR1
SCHEMBL4736217 0.83 PPARA (0.61) PPARAPPARGCYSLTR2CYSLTR1
SCHEMBL4738692 0.80 PPARA (0.65) PPARAPPARGCYSLTR2CYSLTR1
SCHEMBL4739882 0.78 PPARA (0.59) PPARAPPARG
SCHEMBL4738645 0.76 PPARA (0.51) PPARAPPARGCYSLTR2CYSLTR1

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-2008081096-A2 QUINOLINYL DERIVATIVES, METHOD FOR PREPARING SAME, PHARMACEUTIC COMPOSITIONS CONTAINING SAME, AND USE THEREOF AS HYPOGLYCEMIANT AND HYPOLIPEMIANT AGENTS LES LABORATOIRES SERVIER (FR) 2008-07-10 WO disclosed