SCHEMBL15438570

SCHEMBL15438570

C#CCOC(=O)C(C)P(C)(C)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.40
NPC1 O15118 1/20 0.36
TSHR P16473 1/20 0.34
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
CYP1A2 P05177 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CYP2D6 P10635 1/20 0.31
CHRM1 P11229 1/20 0.31
NFKB1 P19838 1/20 0.31
CHRM3 P20309 1/20 0.31
THPO P40225 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
LMNA P02545 1/20 0.30
PMP22 Q01453 1/20 0.30
ZDHHC20 Q5W0Z9 1/20 0.30
CA12 O43570 1/20 0.30

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
SCHEMBL15438168 0.83 ACHE (0.40) ACHENPC1TSHR
SCHEMBL15438358 0.81 TSHR (0.36) ACHENPC1TSHRSLC1A3SLC1A2
SCHEMBL15438527 0.81 ACHE (0.38) ACHENPC1TSHRSLC1A3SLC1A2
SCHEMBL15438937 0.78 ACHE (0.42) ACHENPC1TSHRSLC1A3SLC1A2
SCHEMBL15438417 0.78 ACHE (0.36) ACHENPC1TSHRL3MBTL1ZDHHC20
SCHEMBL15438460 0.77 ACHE (0.38) ACHENPC1TSHRSLC1A3SLC1A2
SCHEMBL10012013 0.77 ACHE (0.41) ACHENPC1TSHRSLC1A3SLC1A2
SCHEMBL4676330 0.76
SCHEMBL10011426 0.76 NPC1 (0.42) ACHENPC1TSHRSLC1A3SLC1A2
SCHEMBL15438978 0.75 TSHR (0.35) ACHENPC1TSHR

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