SCHEMBL15438166

SCHEMBL15438166

C#CCOC(=O)CP(=O)(OCCCC)OCCCC

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
CYP3A4 P08684 2/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.37
LPAR3 Q9UBY5 3/20 0.36
LPAR1 Q92633 2/20 0.36
LPAR2 Q9HBW0 2/20 0.36
ALDH1A1 P00352 1/20 0.35
GSTP1 P09211 1/20 0.34
ATM Q13315 1/20 0.33
TSHR P16473 2/20 0.33
NAAA Q02083 1/20 0.33
DGKA P23743 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
SCHEMBL15438097 0.90 L3MBTL1 (0.38) L3MBTL1ZDHHC20GSTP1TSHR
SCHEMBL15438489 0.86 GSTP1 (0.35) L3MBTL1GSTP1TSHR
SCHEMBL15438419 0.84 GSTP1 (0.34) L3MBTL1CYP3A4ALDH1A1GSTP1TSHR
SCHEMBL15438920 0.83 TSHR (0.43) L3MBTL1ZDHHC20GSTP1TSHR
SCHEMBL2238085 0.83 CYP3A4 (0.48) CYP3A4LPAR3LPAR1LPAR2ALDH1A1
Phosphine SCHEMBL28212339 0.82 TSHR (0.42) L3MBTL1ZDHHC20GSTP1TSHR
SCHEMBL15438324 0.82 GSTP1 (0.33) L3MBTL1GSTP1TSHR
SCHEMBL2354042 0.82 CYP3A4 (0.47) CYP3A4LPAR3LPAR1LPAR2ALDH1A1
SCHEMBL15951705 0.82 CYP3A4 (0.47) CYP3A4LPAR3LPAR1LPAR2ALDH1A1
SCHEMBL15438627 0.81 GSTP1 (0.37) L3MBTL1ALDH1A1GSTP1TSHR

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
EP-2698859-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND ELECTRICITY-STORAGE DEVICE USING THE SAME UBE INDUSTRIES (JP) 2016-07-27 EP disclosed
US-9384906-B2 Non-aqueous electrolyte solution and electricity-storage device using same UBE INDUSTRIES, LTD. (JP) 2016-07-05 US disclosed
EP-2698859-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY-STORAGE DEVICE USING SAME Ube Industries, Ltd. (JP) 2014-02-19 EP disclosed
US-20140030610-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY-STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD (JP) 2014-01-30 US disclosed