SCHEMBL17866504

SCHEMBL17866504

CCCC(=O)OCC(COC(=O)CC)OC(=O)CC

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.61
LMNA P02545 1/20 0.61
PRKCA P17252 4/20 0.51
PRKCE Q02156 2/20 0.51
PRKCQ Q04759 2/20 0.51
PRKCD Q05655 2/20 0.51
LPAR3 Q9UBY5 7/20 0.49
LPAR1 Q92633 4/20 0.49
ENPP2 Q13822 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
LPAR2 Q9HBW0 2/20 0.48

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
Tributyrin SCHEMBL20659218 0.98 ALDH1A1 (0.64) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL5959780 0.96 ALDH1A1 (0.66) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL14032357 0.96 ALDH1A1 (0.66) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL17866526 0.94 ALDH1A1 (0.62) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL1097712 0.91 ALDH1A1 (0.56) ALDH1A1LMNAPRKCAPRKCEPRKCQ
Tributyrin SCHEMBL601928 0.90 ALDH1A1 (0.72) ALDH1A1LMNAPRKCAPRKCEPRKCQ
Tributyrin SCHEMBL23825 0.90 ALDH1A1 (0.72) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL76782 0.90 ALDH1A1 (0.55) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL5308587 0.90 ALDH1A1 (0.55) ALDH1A1LMNAPRKCAPRKCEPRKCQ
SCHEMBL13208745 0.89 PRKCA (0.58) ALDH1A1LMNAPRKCAPRKCEPRKCQ

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-9972866-B2 Electrolyte for lithium secondary battery and lithium secondary battery employing the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-05-15 US claimed
US-20160190649-A1 ELECTROLYTE FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 US claimed
US-9972866-B2 Electrolyte for lithium secondary battery and lithium secondary battery employing the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-05-15 US disclosed
US-20160190649-A1 ELECTROLYTE FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 US disclosed