SCHEMBL4782154

SCHEMBL4782154

CCC(Oc1ccc(C(C)=NOCCN2C(=O)COc3ccccc32)cc1C)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.42
POLB P06746 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 4/20 0.40
TSHR P16473 3/20 0.40
MAPT P10636 1/20 0.39
CBX7 O95931 2/20 0.39
CDYL2 Q8N8U2 2/20 0.39
CDYL Q9Y232 2/20 0.39
CDY1; CDY1B Q9Y6F8 2/20 0.39
CHRM1 P11229 1/20 0.39
TP53 P04637 1/20 0.38
ALOX12 P18054 1/20 0.38
PPARA Q07869 1/20 0.37
GAA P10253 1/20 0.37
LMNA P02545 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
SCHEMBL4726996 0.88 PPARA (0.44) PPARA
SCHEMBL4727002 0.88 PPARA (0.44) PPARA
SCHEMBL4730674 0.85 PPARG (0.49) HSD17B10POLBMEN1KMT2AALDH1A1
SCHEMBL4726775 0.79 PLA2G2A (0.43) ALDH1A1MAPTPPARALMNA
SCHEMBL4729069 0.75 HTT (0.40) HSD17B10MEN1KMT2AALDH1A1TSHR
SCHEMBL4729074 0.75 HTT (0.40) HSD17B10MEN1KMT2AALDH1A1TSHR
SCHEMBL4731801 0.73 PPARG (0.53) PPARA
SCHEMBL4728214 0.72 GRM2 (0.44)
SCHEMBL4728210 0.72 GRM2 (0.44)
SCHEMBL4726804 0.71 PPARG (0.46) PPARA

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