SCHEMBL4730561

SCHEMBL4730561

CCC(Oc1ccc(/C(CC2CCCC2)=N/O)cc1C)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.41
PDE4A P27815 2/20 0.40
PDE4B Q07343 2/20 0.40
PDE4C Q08493 2/20 0.40
PDE4D Q08499 2/20 0.40
PPARG P37231 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.35
P2RX3 P56373 2/20 0.35
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
PPARD Q03181 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GAA P10253 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL4727866 1.00 PPARA (0.53) PPARASMN1; SMN2PDE4APDE4BPDE4C
SCHEMBL4728116 0.99 PPARA (0.54) PPARASMN1; SMN2PDE4APDE4BPDE4C
SCHEMBL4728216 0.82 PPARA (0.50) PPARASMN1; SMN2PPARGPTGDR2TAS1R3
SCHEMBL4728547 0.82 PPARA (0.54) PPARASMN1; SMN2PDE4APDE4BPDE4C
SCHEMBL4728546 0.82 PPARA (0.54) PPARASMN1; SMN2PDE4APDE4BPDE4C
SCHEMBL4729835 0.80 PPARA (0.43) PPARAPDE4APDE4BPDE4CPDE4D
SCHEMBL4728230 0.80 PPARA (0.44) PPARAPDE4APDE4BPDE4CPDE4D
SCHEMBL4730161 0.80 PPARA (0.44) PPARAPDE4APDE4BPDE4CPDE4D
SCHEMBL4729729 0.79 PPARA (0.50) PPARASMN1; SMN2PPARGPTGDR2TAS1R3
SCHEMBL4727820 0.77 PPARA (0.45) PPARASMN1; SMN2PPARGPTGDR2P2RX3

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