SCHEMBL16563221

SCHEMBL16563221

C=CCCCCS(=O)(=O)O.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.[LiH]

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.37
ABCC4 O15439 1/20 0.36
MAPT P10636 1/20 0.36
EPHX2 P34913 1/20 0.36
ALDH1A1 P00352 3/20 0.32
LMNA P02545 2/20 0.32
LPAR2 Q9HBW0 1/20 0.32
LPAR3 Q9UBY5 1/20 0.32
TSHR P16473 2/20 0.32
PTGS1 P23219 1/20 0.30
PDE4A P27815 1/20 0.30
SLC6A6 P31641 1/20 0.30
CYP2C19 P33261 1/20 0.30
BLM P54132 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
SCHEMBL16563694 0.94 APP (0.38) APPABCC4MAPTEPHX2ALDH1A1
SCHEMBL28071889 0.92 APP (0.39) APPABCC4MAPTEPHX2ALDH1A1
SCHEMBL872467 0.89 APP (0.44) APPABCC4MAPTEPHX2ALDH1A1
SCHEMBL16563505 0.88 APP (0.37) APPABCC4MAPTEPHX2ALDH1A1
SCHEMBL23630404 0.87 MAPT (0.46) APPABCC4MAPTEPHX2ALDH1A1
SCHEMBL3693008 0.87 MAPT (0.46) APPABCC4MAPTEPHX2ALDH1A1
SCHEMBL93616 0.87 MAPT (0.46) APPABCC4MAPTEPHX2ALDH1A1
SCHEMBL8218999 0.87 MAPT (0.46) APPABCC4MAPTEPHX2ALDH1A1
SCHEMBL8784927 0.87 MAPT (0.46) APPABCC4MAPTEPHX2ALDH1A1
SCHEMBL3690296 0.87 MAPT (0.46) APPABCC4MAPTEPHX2ALDH1A1

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
US-9595737-B2 Non-aqueous electrolyte and power storage device using same UBE INDUSTRIES, LTD. (JP) 2017-03-14 US disclosed
EP-2849272-B1 NON-AQUEOUS ELECTROLYTE AND POWER STORAGE DEVICE USING SAME UBE INDUSTRIES (JP) 2017-01-11 EP disclosed
US-20150125761-A1 NON-AQUEOUS ELECTROLYTE AND POWER STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2015-05-07 US disclosed
EP-2849272-A1 NON-AQUEOUS ELECTROLYTE AND POWER STORAGE DEVICE USING SAME UBE Industries, Ltd. (JP) 2015-03-18 EP disclosed