SCHEMBL2949604

SCHEMBL2949604

CCOC(=O)C=CC=CC(=O)OCC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.65
MAPT P10636 4/20 0.52
NPSR1 Q6W5P4 1/20 0.50
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
ALDH1A1 P00352 3/20 0.48
ATM Q13315 1/20 0.46
LMNA P02545 2/20 0.46
HSD17B10 Q99714 1/20 0.46
GLO1 Q04760 1/20 0.44
TTR P02766 1/20 0.44
DPP4 P27487 1/20 0.44
ALOX15 P16050 1/20 0.43
MGAM O43451 1/20 0.43
GAA P10253 1/20 0.43
SI P14410 1/20 0.43

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
SCHEMBL10696751 1.00 HCAR2 (0.65) HCAR2MAPTNPSR1CA12CA1
SCHEMBL820970 1.00 HCAR2 (0.65) HCAR2MAPTNPSR1CA12CA1
SCHEMBL28445966 0.97 HCAR2 (0.62) HCAR2MAPTNPSR1CA12CA1
Diethyl Maleate SCHEMBL18255854 0.92 HCAR2 (0.76) HCAR2MAPTNPSR1CA12CA1
Diethyl Maleate SCHEMBL135447 0.92 HCAR2 (0.76) HCAR2MAPTNPSR1CA12CA1
SCHEMBL2946389 0.91 HCAR2 (0.56) HCAR2MAPTNPSR1CA12CA1
SCHEMBL28762346 0.91 HCAR2 (0.75) HCAR2MAPTNPSR1CA12CA1
SCHEMBL11792235 0.91 HCAR2 (0.56) HCAR2MAPTNPSR1CA12CA1
SCHEMBL345935 0.91 HCAR2 (0.56) HCAR2MAPTNPSR1CA12CA1
SCHEMBL345936 0.91 HCAR2 (0.56) HCAR2MAPTNPSR1CA12CA1

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
US-7727677-B2 Nonaqueous electrolyte solution and lithium secondary battery using same UBE INDUSTRIES, LTD. (JP) 2010-06-01 US disclosed
EP-1758198-B1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME UBE INDUSTRIES (JP) 2009-07-08 EP disclosed
US-20080038644-A1 Nonaques Electrolyte Solution And Lithium Secondary Battery Using Same UBE INDUSTRIES, LTD. (JP) 2008-02-14 US disclosed
EP-1758198-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME Ube Industries, Ltd. (JP) 2007-02-28 EP disclosed
US-6232266-B1 COMPRISES TWO OR MORE KINDS OF COMPOUNDS, AND AT LEAST ONE OF WHICH IS FORMED A COLOR-FORMATION CONTROLLING LAYER OBTAINED BY POLYMERIZING A COMPOUND HAVING AN UNSATURATED CARBON BOND. MITSUBISHI PAPER MILLS LIMITED (JP) 2001-05-15 US disclosed