SCHEMBL2414342

SCHEMBL2414342

CCCCCOC(C)(C)N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 10/20 0.39
CA2 P00918 10/20 0.39
CA9 Q16790 9/20 0.39
CA12 O43570 4/20 0.38
CA7 P43166 3/20 0.38
CA14 Q9ULX7 3/20 0.38
CA3 P07451 2/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
CA5A P35218 2/20 0.38
CA5B Q9Y2D0 2/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
GBA1 P04062 2/20 0.37
DNM1 Q05193 1/20 0.37
THRB P10828 2/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 2/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL9006918 0.97 CA1 (0.41) CA1CA2CA9CA12CA7
SCHEMBL2417731 0.92
SCHEMBL16908271 0.85 CA1 (0.34) CA1CA2CA9CA12CA7
SCHEMBL2422140 0.80
SCHEMBL3263695 0.80 CA1 (0.37) CA1CA2CA9CA12CA7
SCHEMBL22788087 0.80 CES1 (0.39) CA1CA2CA9CA12CA7
SCHEMBL29264831 0.80 CA1 (0.37) CA1CA2CA9CA12CA7
SCHEMBL8440337 0.79 DNM1 (0.46) CA1CA2CA9CA12CA7
SCHEMBL252597 0.78 THRB (0.39) CA1CA2CA9CA12CA7
SCHEMBL9498994 0.78 CA1 (0.42) CA1CA2CA9CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1689016-B1 ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE LITHIUM SECONDARY BATTERY COMPRISING THE SAME STELLA CHEMIFA CORP (JP) 2011-09-21 EP disclosed
US-7700243-B2 Electrolyte solution and nonaqueous electrolyte lithium secondary battery OTSUKA CHEMICAL CO., LTD. (JP) 2010-04-20 US disclosed
US-20070037064-A1 contains N,N-diethyl-N-methyl-N-methoxymethylammonium Chloride OTSUKA CHEMICAL CO., LTD. (JP) 2007-02-15 US disclosed
EP-1689016-A1 ELECTROLYTE SOLUTION AND NONAQUEOUS ELECTROLYTE LITHIUM SECONDARY BATTERY Stella Chemifa Corporation (JP) 2006-08-09 EP disclosed