SCHEMBL872425

SCHEMBL872425

CCN(CCOC)C(=O)OCC(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.48
GAA P10253 1/20 0.36
ALOX12 P18054 1/20 0.36
HTT P42858 1/20 0.36
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
LRRK2 Q5S007 2/20 0.32
NAMPT P43490 1/20 0.31
ADORA2B P29275 1/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL2924105 0.84 HTT (0.45) MLYCDHTTLMNAMEN1KMT2A
SCHEMBL871320 0.83 HTT (0.38) MLYCDHTTMEN1KMT2A
SCHEMBL872850 0.79 MLYCD (0.43) MLYCDGAAALOX12SLC6A2SLC6A4
SCHEMBL871173 0.79 HDAC4 (0.41) MLYCDGAAALOX12HTTLRRK2
SCHEMBL21984714 0.76 HTT (0.38) MLYCDHTTMEN1KMT2A
SCHEMBL20365669 0.74 MLYCD (0.44) MLYCDSLC6A2SLC6A4NAMPTLMNA
SCHEMBL871235 0.73 MLYCD (0.45) MLYCDGAAALOX12SLC6A2SLC6A4
SCHEMBL871772 0.72 MLYCD (0.47) MLYCDGAASLC6A2SLC6A4NAMPT
SCHEMBL11929806 0.70 MLYCD (0.46) MLYCDSLC6A2SLC6A4NAMPTLMNA
SCHEMBL12928351 0.70 MEN1 (0.42) MLYCDGAALMNAMEN1KMT2A

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