SCHEMBL15438489

SCHEMBL15438489

C#CCCCOP(=O)(CC(=O)OCC#C)OCCCC#C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.32
TSHR P16473 1/20 0.32
NPC1 O15118 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL15438419 0.95 GSTP1 (0.34) GSTP1L3MBTL1TSHRNPC1CYP1A2
SCHEMBL15438324 0.90 GSTP1 (0.33) GSTP1L3MBTL1TSHRNPC1
SCHEMBL15438166 0.86 L3MBTL1 (0.43) GSTP1L3MBTL1TSHR
SCHEMBL15438627 0.83 GSTP1 (0.37) GSTP1L3MBTL1TSHRNPC1
SCHEMBL15438097 0.82 L3MBTL1 (0.38) GSTP1L3MBTL1TSHRNPC1
SCHEMBL15438213 0.82 LPAR3 (0.41) GSTP1L3MBTL1
SCHEMBL15438506 0.81 LPAR3 (0.46) GSTP1MAPT
SCHEMBL15438145 0.79 TSHR (0.38) TSHRCYP1A2CYP2D6MAPTCYP2C9
SCHEMBL15438970 0.78 LPAR2 (0.33) GSTP1
SCHEMBL15438920 0.78 TSHR (0.43) GSTP1L3MBTL1TSHRNPC1MAPT

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