SCHEMBL4728913

SCHEMBL4728913

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

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.51
SMN1; SMN2 Q16637 1/20 0.47
PPARG P37231 10/20 0.45
PPARD Q03181 2/20 0.39
PTGDR2 Q9Y5Y4 2/20 0.39
TSHR P16473 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
FFAR4 Q5NUL3 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
SCHEMBL4728218 0.86 PPARA (0.47) PPARASMN1; SMN2PPARGPPARDPTGDR2
SCHEMBL5860631 0.80 PPARA (0.56) PPARASMN1; SMN2PPARGPPARDPTGDR2
SCHEMBL4728593 0.79 PPARA (0.48) PPARASMN1; SMN2PPARGPPARDPTGDR2
SCHEMBL4729759 0.78 PPARA (0.41) PPARASMN1; SMN2PPARGPPARDFFAR4
SCHEMBL4729733 0.77 PPARA (0.48) PPARASMN1; SMN2PPARGPPARDPTGDR2
SCHEMBL8935691 0.77 PPARA (0.61) PPARASMN1; SMN2PPARGPPARDPTGDR2
SCHEMBL8935696 0.77 PPARA (0.61) PPARASMN1; SMN2PPARGPPARDPTGDR2
SCHEMBL4727868 0.76 PPARA (0.50) PPARASMN1; SMN2PPARGPPARDPTGDR2
SCHEMBL4726776 0.76 PPARA (0.44) PPARASMN1; SMN2PPARGPPARD
SCHEMBL1245354 0.76 PPARA (0.60) PPARASMN1; SMN2PPARGPPARDPTGDR2

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 disclosed