SCHEMBL4728550

SCHEMBL4728550

CCC(Oc1ccc(/C(Cc2ccccc2)=N/OCc2ccc(C(F)(F)F)cc2)cc1C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 13/20 0.49
PPARG P37231 12/20 0.49
PPARD Q03181 7/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.43
S1PR1 P21453 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38

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
SCHEMBL4727840 1.00 PPARA (0.49) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4730612 0.93 PPARA (0.45) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4728640 0.93 PPARA (0.45) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4727843 0.93 PPARA (0.51) PPARAPPARGPPARDPTGDR2
SCHEMBL4726363 0.89 PPARA (0.47) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4726348 0.89 PPARA (0.45) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4728644 0.89 PPARA (0.45) PPARAPPARGPPARDPTGDR2S1PR1
SCHEMBL4726964 0.87 PPARD (0.65) PPARAPPARGPPARD
SCHEMBL4726957 0.87 PPARD (0.65) PPARAPPARGPPARD
SCHEMBL4728590 0.86 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