SCHEMBL4730698

SCHEMBL4730698

Cc1ccc(-c2nc(CO/N=C(/c3ccc(OCC(=O)O)c(C)c3)C3CCCCC3)c(C)o2)cc1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 13/20 0.73
PPARA Q07869 13/20 0.73
PPARD Q03181 7/20 0.73
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39

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
SCHEMBL4730701 1.00 PPARG (0.73) PPARGPPARAPPARDKDM4EALDH1A1
SCHEMBL4729121 0.86 PPARA (0.54) PPARGPPARAPPARDKDM4EALDH1A1
SCHEMBL4729122 0.86 PPARA (0.54) PPARGPPARAPPARDKDM4EALDH1A1
SCHEMBL4726352 0.85 PPARG (1.00) PPARGPPARAPPARDTP53MAPT
SCHEMBL4731269 0.83 PPARG (0.79) PPARGPPARAPPARDTP53MAPT
SCHEMBL4731275 0.83 PPARG (0.79) PPARGPPARAPPARDTP53MAPT
SCHEMBL4782933 0.82 PPARG (0.78) PPARGPPARAPPARDTP53MAPT
SCHEMBL4727541 0.82 PPARG (0.78) PPARGPPARAPPARDTP53MAPT
SCHEMBL4899515 0.81 PPARG (0.76) PPARGPPARAPPARDTP53MAPT
SCHEMBL4729536 0.81 PPARG (0.76) PPARGPPARAPPARDTP53MAPT

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