SCHEMBL4727337

SCHEMBL4727337

CCC(Oc1ccc(/C(=N\OCc2ccc(C(F)(F)F)cc2)C2CCCCC2)cc1C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 9/20 0.57
PPARG P37231 8/20 0.57
PPARD Q03181 7/20 0.57
PTGDR2 Q9Y5Y4 1/20 0.43
S1PR1 P21453 5/20 0.39
S1PR3 Q99500 4/20 0.39
S1PR4 O95977 1/20 0.36
S1PR5 Q9H228 1/20 0.36
ALOX5 P09917 1/20 0.36
CCR5 P51681 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35

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
SCHEMBL4727340 1.00 PPARA (0.57) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4726361 0.87 PPARD (0.77) PPARAPPARGPPARD
SCHEMBL4730161 0.87 PPARA (0.44) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4728230 0.87 PPARA (0.44) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4728235 0.87 PPARA (0.44) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4729835 0.86 PPARA (0.43) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4729838 0.86 PPARD (0.44) PPARAPPARGPPARDPTGDR2ALOX5
SCHEMBL4726569 0.84 PPARD (0.76) PPARAPPARGPPARDPTGDR2
SCHEMBL4726571 0.84 PPARD (0.76) PPARAPPARGPPARDPTGDR2
SCHEMBL4728590 0.84 PPARA (0.60) PPARAPPARGPPARDPTGDR2S1PR1

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-2008035359-A2 OXIMINOPHENOXYALKANOIC ACID AND PHENYLALKANOIC ACID DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2008-03-27 WO claimed
WO-2008035359-A2 OXIMINOPHENOXYALKANOIC ACID AND PHENYLALKANOIC ACID DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2008-03-27 WO disclosed