SCHEMBL2160653

SCHEMBL2160653

CC(COC=O)(COC(=O)C1CC1)COC(=O)C1CC1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MAPT P10636 3/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
ALDH1A1 P00352 5/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TSHR P16473 1/20 0.33
RECQL P46063 1/20 0.33
ATM Q13315 1/20 0.33
GAA P10253 1/20 0.32
PKM P14618 1/20 0.32
HTT P42858 1/20 0.32
HSD11B1 P28845 1/20 0.32

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
SCHEMBL2161527 0.93 ADRB2 (0.39) NPC1RAB9AMAPTADRB2ADRB1
SCHEMBL2160506 0.93 ADRB2 (0.42) NPC1RAB9AMAPTADRB2ADRB1
SCHEMBL2161061 0.92 ALDH1A1 (0.43) ADRB2ADRB1ADRB3ALDH1A1MEN1
SCHEMBL25481019 0.81 MEN1 (0.36) NPC1RAB9AMAPTALDH1A1MEN1
SCHEMBL2160651 0.80 MAPT (0.36) NPC1RAB9AMAPTALDH1A1MEN1
SCHEMBL27055895 0.78 ALDH1A1 (0.44) NPC1RAB9AMAPTADRB2ADRB1
SCHEMBL2160628 0.77 LMNA (0.36) ALDH1A1
SCHEMBL6141219 0.75 RAB9A (0.43) NPC1RAB9AMAPTADRB2ADRB1
SCHEMBL27787983 0.75 MAPT (0.42) NPC1RAB9AMAPTADRB2ADRB1
SCHEMBL27055950 0.75 ALDH1A1 (0.41) NPC1RAB9AMAPTADRB2ADRB1

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-7985502-B2 Containing formic ester additive; cycling properties, electrical capacity, storage during charging UBE INDUSTRIES, LTD. (JP) 2011-07-26 US disclosed
EP-1729365-B1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING THE SAME UBE INDUSTRIES (JP) 2010-12-22 EP disclosed
US-20080241704-A1 Nonaqueous Electrolyte Solution and Lithium Secondary Battery Using Same UBE INDUSTRIES, LTD (JP) 2008-10-02 US disclosed
EP-1729365-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME Ube Industries, Ltd. (JP) 2006-12-06 EP disclosed