SCHEMBL15908308

SCHEMBL15908308

CC[N+](C)(CC)CCOCCOCCOC

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
CHRM4 P08173 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32
CA2 P00918 1/20 0.31
BBOX1 O75936 1/20 0.30
CHRM2 P08172 1/20 0.30

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
SCHEMBL15908311 1.00 BCHE (0.33) BCHEACHECHRM4CHRM1CHRM3
SCHEMBL1277086 1.00 BCHE (0.33) BCHEACHECHRM4CHRM1CHRM3
Hydrochloric Acid SCHEMBL29201358 0.98 BCHE (0.32) BCHEACHECHRM4CHRM1CHRM3
Bromide SCHEMBL29201326 0.98 CHRM4 (0.35) BCHEACHECHRM4CHRM1CHRM3
Iodide SCHEMBL29201341 0.98 CHRNB4 (0.34) BCHEACHECHRM4CHRM1CHRM3
SCHEMBL1277026 0.92
SCHEMBL16674081 0.90 CHRM1 (0.36) BCHEACHECHRM4CHRM1CHRM3
Iodide SCHEMBL30354174 0.87 CHRNB4 (0.38) BCHEACHECHRM4CHRM1CHRM3
SCHEMBL10452395 0.87 CHRM1 (0.37) BCHEACHECHRM4CHRM1CHRM3
Bicarbonate SCHEMBL30869326 0.87 BBOX1 (0.43) CHRM4CHRM1CHRM3BBOX1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9306253-B2 Electrolyte solution for lithium-air battery TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 2016-04-05 US disclosed
US-20140212772-A1 ELECTROLYTE SOLUTION FOR LITHIUM-AIR BATTERY TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 2014-07-31 US disclosed