SCHEMBL4729667

SCHEMBL4729667

CCC(Oc1ccc(CCC=NO)cc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.50
PPARG P37231 18/20 0.49
PPARA Q07869 18/20 0.49

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
SCHEMBL4731340 0.92 PPARA (0.51) SMN1; SMN2PPARGPPARA
SCHEMBL8387983 0.85 SMN1; SMN2 (0.54) SMN1; SMN2PPARGPPARA
SCHEMBL4727918 0.81 PPARG (0.46) SMN1; SMN2PPARGPPARA
SCHEMBL4730221 0.81 PPARG (0.47) SMN1; SMN2PPARGPPARA
SCHEMBL4728887 0.81 PPARG (0.46) SMN1; SMN2PPARGPPARA
SCHEMBL27596214 0.80 PPARA (0.55) SMN1; SMN2PPARGPPARA
SCHEMBL5830085 0.79 SMN1; SMN2 (0.56) SMN1; SMN2PPARGPPARA
SCHEMBL8935920 0.78 PPARG (0.71) SMN1; SMN2PPARGPPARA
SCHEMBL8935911 0.78 PPARG (0.71) SMN1; SMN2PPARGPPARA
SCHEMBL4726779 0.78 PPARG (0.48) SMN1; SMN2PPARGPPARA

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