SCHEMBL4730345

SCHEMBL4730345

C/C(=N\OCCn1c2ccccc2c2ccccc21)c1ccc(OCC(=O)O)c(C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.53
PPARA Q07869 9/20 0.53
PPARD Q03181 4/20 0.53
PLA2G2A P14555 1/20 0.47
MAPT P10636 3/20 0.45
ALDH1A1 P00352 2/20 0.45
PKM P14618 1/20 0.45
PSEN1 P49768 5/20 0.43
PSEN2 P49810 5/20 0.43
APH1B Q8WW43 5/20 0.43
NCSTN Q92542 5/20 0.43
APH1A Q96BI3 5/20 0.43
PSENEN Q9NZ42 5/20 0.43
HPGD P15428 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL4727953 0.87 PLA2G2A (0.49) PPARGPPARAPPARDPLA2G2AMAPT
SCHEMBL4726512 0.87 PLA2G2A (0.49) PPARGPPARAPPARDPLA2G2AMAPT
SCHEMBL4729526 0.87 PLA2G2A (0.43) PPARGPPARAPPARDPLA2G2AMAPT
SCHEMBL4729524 0.87 PLA2G2A (0.43) PPARGPPARAPPARDPLA2G2AMAPT
SCHEMBL4729531 0.83 MAPT (0.43) PPARGPPARAPPARDPLA2G2AMAPT
SCHEMBL4726775 0.83 PLA2G2A (0.43) PPARGPPARAPPARDPLA2G2AMAPT
SCHEMBL4731801 0.80 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL4726516 0.79 PSEN1 (0.44) PPARGPPARAPPARDPLA2G2AMAPT
SCHEMBL4730346 0.78 PSEN1 (0.44) PPARGPPARAPPARDPLA2G2AMAPT
SCHEMBL4728559 0.78 HPGD (0.47) PPARGPPARAPPARDALDH1A1HPGD

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