SCHEMBL4726337

SCHEMBL4726337

Cc1cc(/C(=N\OCCn2ccc3ccccc32)C2CCCCC2)ccc1OCC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.51
PPARA Q07869 4/20 0.51
PPARD Q03181 3/20 0.51
TSHR P16473 2/20 0.43
TP53 P04637 2/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MTNR1A P48039 2/20 0.39
MTNR1B P49286 2/20 0.39
MCL1 Q07820 9/20 0.39
HTT P42858 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37

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
SCHEMBL4726340 1.00 PPARG (0.51) PPARGPPARAPPARDTSHRTP53
SCHEMBL4729736 0.86 SMN1; SMN2 (0.41) PPARGPPARAPPARDTSHRTP53
SCHEMBL4729739 0.86 SMN1; SMN2 (0.41) PPARGPPARAPPARDTSHRTP53
SCHEMBL4727006 0.81 MCL1 (0.43) PPARGPPARAPPARDTSHRHSD17B10
SCHEMBL4727000 0.81 MCL1 (0.43) PPARGPPARAPPARDTSHRHSD17B10
SCHEMBL4727010 0.79 MCL1 (0.44) PPARGPPARAPPARDTSHRTP53
SCHEMBL4726569 0.72 PPARD (0.76) PPARGPPARAPPARDPTGDR2
SCHEMBL4726571 0.72 PPARD (0.76) PPARGPPARAPPARDPTGDR2
SCHEMBL4729074 0.69 HTT (0.40) PPARGPPARAPPARDTSHRTP53
SCHEMBL4729069 0.69 HTT (0.40) PPARGPPARAPPARDTSHRTP53

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