SCHEMBL5484842

SCHEMBL5484842

CCC(COC)OC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ACACB O00763 2/20 0.34
LPAR6 P43657 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR4 Q99677 1/20 0.33
LPAR5 Q9H1C0 1/20 0.33
LPAR2 Q9HBW0 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33
PRKCA P17252 2/20 0.32
PRKCD Q05655 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 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
SCHEMBL5483242 0.85 MEN1 (0.33) MEN1KMT2ALPAR1LPAR3ALDH1A1
SCHEMBL1469728 0.84 ACACB (0.38) MEN1KMT2AACACBLPAR6LPAR1
SCHEMBL11631788 0.84 TSHR (0.39) MEN1KMT2APRKCAPRKCDALDH1A1
SCHEMBL180146 0.83
SCHEMBL162345 0.82 ALDH1A1 (0.36) PRKCAPRKCDALDH1A1
SCHEMBL4567273 0.82 PRKCA (0.42) MEN1KMT2AACACBPRKCAALDH1A1
SCHEMBL1469110 0.82 ACACB (0.40) MEN1KMT2AACACBLPAR6LPAR1
SCHEMBL13534692 0.81
Ethylene Glycol SCHEMBL4892632 0.81 PRKCA (0.35) PRKCAPRKCDALDH1A1
Bicarbonate SCHEMBL3240523 0.80 CTSK (0.36) PRKCAPRKCDMAPTMAPK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3091603-B1 ELECTROLYTIC SOLUTION AND ELECTROCHEMICAL DEVICE DAIKIN IND LTD (JP) 2020-01-29 EP disclosed
US-9231274-B2 Nonaqueous electrolyte solution and lithium secondary battery using same MITSUBISHI CHEMICAL CORPORATION (JP) 2016-01-05 US disclosed
US-20130196225-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2013-08-01 US disclosed
US-20130095379-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME KOTATO MINORU (JP) 2013-04-18 US disclosed
EP-1744394-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2007-01-17 EP disclosed