SCHEMBL5487674

SCHEMBL5487674

CCCCC(CCOCC(CC)OCC)OC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.36
PRKCD Q05655 1/20 0.36
PLA2G2C Q5R387 3/20 0.35
CTSK P43235 2/20 0.35
CA2 P00918 2/20 0.35
MAPK1 P28482 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP14 P50281 1/20 0.35
CYP3A4 P08684 3/20 0.33
LPAR1 Q92633 2/20 0.33
LPAR3 Q9UBY5 2/20 0.33
TSHR P16473 2/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CA1 P00915 1/20 0.33
TLR2 O60603 2/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL5489530 0.89 PRKCA (0.38) PRKCAPRKCDPLA2G2CCTSKCA2
SCHEMBL5476609 0.82 PRKCA (0.38) PRKCAPRKCDPLA2G2CCTSKCA2
SCHEMBL5480671 0.81 LPAR1 (0.41) PRKCAPRKCDPLA2G2CLPAR1LPAR3
SCHEMBL5489816 0.81 LPAR1 (0.42) PRKCAPRKCDPLA2G2CLPAR1LPAR3
SCHEMBL5483221 0.80 TSHR (0.39) PRKCAPRKCDPLA2G2CCTSKCA2
SCHEMBL5487685 0.79 CA2 (0.39) PRKCAPRKCDPLA2G2CCTSKCA2
SCHEMBL608475 0.79 PRKCA (0.50) PRKCAPRKCDCTSKCA2MAPK1
SCHEMBL1837070 0.79 CA2 (0.46) PRKCAPRKCDCTSKCA2MAPK1
SCHEMBL5916675 0.77 USP2 (0.39) PLA2G2CMMP9MMP8MMP14CYP3A4
Hydrochloric Acid SCHEMBL11109903 0.77 PRKCA (0.49) PRKCAPRKCDCTSKCA2MAPK1

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
EP-1744394-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2007-01-17 EP disclosed