SCHEMBL28055079

SCHEMBL28055079

CC(CC=O)CCCCC(=O)OC(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
ALDH1A1 P00352 4/20 0.36
GAA P10253 1/20 0.36
EPHX2 P34913 1/20 0.36
CYP3A4 P08684 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 4/20 0.35
MAPK1 P28482 1/20 0.35
PGR P06401 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
ADRA2C P18825 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2B P41595 1/20 0.33
MC3R P41968 1/20 0.33
SLC6A3 Q01959 1/20 0.33
PDE4D Q08499 1/20 0.33
SCN5A Q14524 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 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
SCHEMBL28055065 0.95 LMNA (0.50) LMNAALDH1A1GAAEPHX2CYP3A4
SCHEMBL28055029 0.81 CYP1A2 (0.46) LMNAALDH1A1GAACYP3A4TDP1
SCHEMBL495005 0.80 LMNA (0.63) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL494651 0.80 LMNA (0.63) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL493891 0.80 LMNA (0.63) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL494424 0.80 LMNA (0.63) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL495319 0.80 LMNA (0.63) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL494931 0.80 LMNA (0.63) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL495425 0.80 LMNA (0.63) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL495343 0.80 LMNA (0.63) LMNAALDH1A1GAAEPHX2MAPT

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
CN-105406119-B A kind of lithium-ion battery electrolytes and the lithium ion battery containing the electrolyte 比亚迪股份有限公司 2018-05-29 CN disclosed
CN-105406119-A Lithium ion battery electrolyte and lithium ion battery containing electrolyte BYD CO LTD 2016-03-16 CN disclosed