SCHEMBL7128877

SCHEMBL7128877

CC/C(OC(=O)O)=C(\OC(=O)O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.47
CES2 O00748 2/20 0.47
LMNA P02545 2/20 0.43
ELANE P08246 1/20 0.42
TSHR P16473 2/20 0.41
PGR P06401 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
KCNH2 Q12809 1/20 0.41
MAPT P10636 3/20 0.40
PRSS1 P07477 2/20 0.40
CTSG P08311 2/20 0.40
CTRB1 P17538 2/20 0.40
CMA1 P23946 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ATM Q13315 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL703632 0.81 CES1 (0.50) CES1CES2LMNATSHRMAPT
SCHEMBL981800 0.76 CES2 (0.45) CES1CES2LMNAELANETSHR
SCHEMBL10179795 0.72 F2 (0.41) CES1CES2LMNATSHRMAPT
SCHEMBL704833 0.71 FFAR3 (0.47) LMNATSHRGAAALOX15TDP1
SCHEMBL1603613 0.69 CES1 (0.50) CES1CES2LMNAELANETSHR
Propiophenone SCHEMBL28510486 0.68 SMN1; SMN2 (0.62) CES1CES2LMNATSHRMAPT
Propiophenone SCHEMBL318818 0.68 SMN1; SMN2 (0.75) CES1CES2LMNATSHRMAPT
Propiophenone SCHEMBL76464 0.68 SMN1; SMN2 (0.75) CES1CES2LMNATSHRMAPT
Propiophenone SCHEMBL14244535 0.68 SMN1; SMN2 (0.75) CES1CES2LMNATSHRMAPT
Benzophenone SCHEMBL9458360 0.68 ALDH1A1 (0.74) CES1CES2LMNAELANETSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6664008-B1 Comprising solute, cyclic carbonate solvent, and separator; lithium batteries MITSUBISHI CHEMICAL CORPORATION (JP) 2003-12-16 US claimed
US-6664008-B1 Comprising solute, cyclic carbonate solvent, and separator; lithium batteries MITSUBISHI CHEMICAL CORPORATION (JP) 2003-12-16 US disclosed
EP-1096592-A1 SECONDARY BATTERY HAVING NONAQUEOUS ELECTROLYTE SOLUTION MITSUBISHI CHEMICAL CORPORATION (JP) 2001-05-02 EP disclosed