SCHEMBL16660461

SCHEMBL16660461

COCCN(C)C(=O)OCOC

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.40
CHRNA4 P43681 3/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRM2 P08172 2/20 0.38
CHRM4 P08173 2/20 0.38
CHRM5 P08912 2/20 0.38
CHRM1 P11229 2/20 0.38
CHRM3 P20309 2/20 0.38
PIK3CD O00329 1/20 0.33
NAMPT P43490 1/20 0.33
HDAC4 P56524 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33

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
SCHEMBL301733 0.85 CHRNB2 (0.44) CHRNB2CHRNA4CHRNB4CHRNA3CHRM2
SCHEMBL17623039 0.83 CHRNB2 (0.40) CHRNB2CHRNA4CHRNB4CHRNA3CHRM2
SCHEMBL15689619 0.82 CHRNB2 (0.39) CHRNB2CHRNA4CHRNB4CHRNA3CHRM2
SCHEMBL872556 0.80 CHRNB2 (0.37) CHRNB2CHRNA4CHRNB4CHRNA3CHRM2
SCHEMBL871182 0.80 CHRNB2 (0.45) CHRNB2CHRNA4CHRNB4CHRNA3CHRM2
SCHEMBL24477471 0.79 CHRNB2 (0.44) CHRNB2CHRNA4CHRNB4CHRNA3CHRM2
SCHEMBL871173 0.77 HDAC4 (0.41) CHRNB2CHRNA4CHRNB4CHRNA3CHRM2
SCHEMBL15689633 0.77 CHRNB2 (0.34) CHRNB2CHRNA4CHRNB4CHRNA3CHRM2
SCHEMBL1714516 0.73 PDK2 (0.40) CHRNB2CHRNA4CHRNB4CHRNA3CHRM2
SCHEMBL17191610 0.73 PIK3CD (0.41) CHRNB2CHRNA4CHRNB4CHRNA3CHRM2

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-9017879-B2 Electrolyte having eutectic mixture and electrochemical device containing the same LG CHEM, LTD. (KR) 2015-04-28 US claimed
EP-2378601-B1 ELECTROLYTE CONTAINING A EUTECTIC MIXTURE AND A SPECIFIC NITRILE COMPOUND, AND ELECTROCHEMICAL DEVICE COMPRISING THE SAME LG CHEMICAL LTD (KR) 2016-03-30 EP disclosed