SCHEMBL17456540

SCHEMBL17456540

O=S(=O)(O)OC1CCC(OS(=O)(=O)O)CC1.[LiH]

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.39
CA1 P00915 1/20 0.39
GRIN1 Q05586 12/20 0.36
GRIN2B Q13224 12/20 0.36
GRIN2D O15399 2/20 0.36
GRIN2A Q12879 2/20 0.36
GRIN2C Q14957 2/20 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
SCHEMBL16160748 0.97 CA2 (0.40) CA2CA1GRIN1GRIN2BGRIN2D
SCHEMBL13976245 0.97
SCHEMBL3130594 0.86 CA2 (0.54) CA2CA1GRIN1GRIN2BGRIN2D
SCHEMBL17469919 0.86 GRIN1 (0.41) GRIN1GRIN2BGRIN2DGRIN2AGRIN2C
SCHEMBL8772824 0.85 CA1 (0.38) CA2CA1GRIN1GRIN2BGRIN2D
Guanidine SCHEMBL6645147 0.85 CA1 (0.38) CA2CA1GRIN1GRIN2BGRIN2D
SCHEMBL18631967 0.85 GRIN1 (0.33) CA2CA1GRIN1GRIN2BGRIN2D
SCHEMBL11575485 0.83 CA1 (0.58) CA2CA1GRIN1GRIN2B
SCHEMBL5155129 0.83 CA1 (0.58) CA2CA1GRIN1GRIN2B
SCHEMBL17466307 0.81 GRIN1 (0.31) CA2CA1GRIN1GRIN2BGRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9934911-B2 Nonaqueous electrolyte solution and electricity storage device using same UBE INDUSTRIES, LTD. (JP) 2018-04-03 US disclosed
EP-2983233-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE Industries, Ltd. (JP) 2016-02-10 EP disclosed
US-20160027592-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2016-01-28 US disclosed