SCHEMBL871736

SCHEMBL871736

COCCNC(=O)OCCF

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.47
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41

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
SCHEMBL871693 0.89 ACHE (0.53) ACHE
Ammonia Solution, Strong SCHEMBL9998424 0.83 ACHE (0.55) ACHEMEN1KMT2A
SCHEMBL22609108 0.83 ACHE (0.48) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL12223304 0.82 ACHE (0.59) ACHEMEN1KMT2ACHRNB2CHRNB4
SCHEMBL12590855 0.82 ACHE (0.59) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL20123404 0.82 ACHE (0.44) ACHEMEN1KMT2A
SCHEMBL872042 0.82 ACHE (0.40) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL15223682 0.80 ACHE (0.52) ACHEMEN1KMT2A
SCHEMBL92124 0.79 CHRNB2 (0.45) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL9493217 0.79 ACHE (0.50) ACHEMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2525433-B1 ELECTROLYTE CONTAINING AN AMIDE COMPOUND, AND ELECTROCHEMICAL DEVICE COMPRISING THE SAME LG CHEMICAL LTD (KR) 2016-12-07 EP claimed
US-8703345-B2 Electrolyte including amide compound and electrochemical device including the same LG CHEM, LTD. (KR) 2014-04-22 US claimed
EP-2525433-A2 ELECTROLYTE COMPRISING AN AMIDE COMPOUND, AND ELECTROCHEMICAL DEVICE COMPRISING THE ELECTROLYTE LG Chem, Ltd. (KR) 2012-11-21 EP claimed
US-20120077091-A1 ELECTROLYTE INCLUDING AMIDE COMPOUND AND ELECTROCHEMICAL DEVICE INCLUDING THE SAME LG CHEM, LTD. (KR) 2012-03-29 US claimed
EP-2525433-B1 ELECTROLYTE CONTAINING AN AMIDE COMPOUND, AND ELECTROCHEMICAL DEVICE COMPRISING THE SAME LG CHEMICAL LTD (KR) 2016-12-07 EP disclosed
US-8703345-B2 Electrolyte including amide compound and electrochemical device including the same LG CHEM, LTD. (KR) 2014-04-22 US disclosed
EP-2525433-A2 ELECTROLYTE COMPRISING AN AMIDE COMPOUND, AND ELECTROCHEMICAL DEVICE COMPRISING THE ELECTROLYTE LG Chem, Ltd. (KR) 2012-11-21 EP disclosed
US-20120077091-A1 ELECTROLYTE INCLUDING AMIDE COMPOUND AND ELECTROCHEMICAL DEVICE INCLUDING THE SAME LG CHEM, LTD. (KR) 2012-03-29 US disclosed