SCHEMBL4728547

SCHEMBL4728547

CCC(Oc1ccc(C(=NO)C2CCCCC2)cc1C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 6/20 0.54
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
PPARG P37231 4/20 0.38
PPARD Q03181 2/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
PDE4B Q07343 2/20 0.35
PDE4D Q08499 2/20 0.35
TAS1R3 Q7RTX0 2/20 0.35
TAS1R1 Q7RTX1 2/20 0.35
PDE4A P27815 1/20 0.34
PDE4C Q08493 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
SCHEMBL4728546 1.00 PPARA (0.54) PPARASMN1; SMN2LMNAGAAPPARG
SCHEMBL4728116 0.83 PPARA (0.54) PPARASMN1; SMN2PPARGPTGDR2PDE4B
SCHEMBL4730561 0.82 PPARA (0.53) PPARASMN1; SMN2GAAPPARGPPARD
SCHEMBL4727866 0.82 PPARA (0.53) PPARASMN1; SMN2GAAPPARGPPARD
SCHEMBL4728120 0.81 PPARA (0.52) PPARASMN1; SMN2PPARGPPARDPTGDR2
SCHEMBL4727337 0.80 PPARA (0.57) PPARAPPARGPPARDPTGDR2
SCHEMBL4727340 0.80 PPARA (0.57) PPARAPPARGPPARDPTGDR2
SCHEMBL4727868 0.80 PPARA (0.50) PPARASMN1; SMN2PPARGPPARDPTGDR2
SCHEMBL4729739 0.77 SMN1; SMN2 (0.41) PPARASMN1; SMN2LMNAPPARGPPARD
SCHEMBL4729736 0.77 SMN1; SMN2 (0.41) PPARASMN1; SMN2LMNAPPARGPPARD

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