SCHEMBL4736217

SCHEMBL4736217

O=C(O)CCCC#CCC(O)c1cc2ccccc2nc1OCCCCCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.61
PPARG P37231 11/20 0.61
CYSLTR1 Q9Y271 4/20 0.41
CYSLTR2 Q9NS75 3/20 0.41
LTB4R Q15722 2/20 0.40
PPARD Q03181 1/20 0.38
RXRA P19793 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36

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
SCHEMBL4738651 0.92 PPARA (0.68) PPARAPPARGCYSLTR1CYSLTR2LTB4R
SCHEMBL4740467 0.91 PPARA (0.63) PPARAPPARGCYSLTR1CYSLTR2LTB4R
SCHEMBL4740472 0.89 PPARA (0.63) PPARAPPARGCYSLTR1CYSLTR2LTB4R
SCHEMBL4738592 0.88 PPARA (0.68) PPARAPPARGCYSLTR1CYSLTR2
SCHEMBL4739535 0.88 PPARA (0.65) PPARAPPARGCYSLTR1CYSLTR2LTB4R
SCHEMBL4736308 0.85 PPARA (0.65) PPARAPPARGCYSLTR1CYSLTR2
SCHEMBL4738676 0.83 PPARA (0.63) PPARAPPARGCYSLTR1CYSLTR2
SCHEMBL4740397 0.83 PPARG (0.45) PPARAPPARGCYSLTR1CYSLTR2PPARD
SCHEMBL4738692 0.81 PPARA (0.65) PPARAPPARGCYSLTR1CYSLTR2
SCHEMBL4739882 0.80 PPARA (0.59) PPARAPPARGLTB4R

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