SCHEMBL4729305

SCHEMBL4729305

CCC(C(=O)O)c1ccc(/C(C)=N/OCCn2c3ccccc3c3ccccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.42
ALDH1A1 P00352 2/20 0.42
PPARA Q07869 5/20 0.41
PPARG P37231 4/20 0.41
PPARD Q03181 1/20 0.41
CNR2 P34972 3/20 0.41
FABP4 P15090 2/20 0.39
FABP5 Q01469 2/20 0.39
FABP3 P05413 1/20 0.39
PTGS2 P35354 1/20 0.39
LMNA P02545 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 2/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTGER4 P35408 1/20 0.37
GMNN O75496 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL4728559 0.80 HPGD (0.47) HPGDALDH1A1PPARAPPARGPPARD
SCHEMBL4728637 0.80 HPGD (0.47) HPGDALDH1A1PPARAPPARGPPARD
SCHEMBL4729307 0.79 PPARG (0.45) HPGDALDH1A1PPARAPPARGPPARD
SCHEMBL4726775 0.77 PLA2G2A (0.43) HPGDALDH1A1PPARAPPARGPPARD
SCHEMBL4730345 0.72 PPARG (0.53) HPGDALDH1A1PPARAPPARGPPARD
SCHEMBL4727545 0.69 PPARG (0.46) ALDH1A1PPARAPPARGLMNAL3MBTL1
SCHEMBL4727542 0.69 PPARG (0.46) ALDH1A1PPARAPPARGLMNAL3MBTL1
SCHEMBL13144239 0.68 PTGS2 (0.50) HPGDALDH1A1PPARAPPARGPPARD
SCHEMBL4726529 0.68 PLA2G2A (0.44) HPGDALDH1A1PPARAPPARGPPARD
SCHEMBL4726530 0.68 PLA2G2A (0.44) HPGDALDH1A1PPARAPPARGPPARD

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