SCHEMBL15439233

SCHEMBL15439233

COP(=O)(CC(=O)OCCCOC(=O)CP(=O)(OC)OC)OC

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.38
TDP1 Q9NUW8 1/20 0.35
KMT2A Q03164 4/20 0.34
MEN1 O00255 2/20 0.34
DGKA P23743 1/20 0.33
RAD52 P43351 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
FAAH O00519 1/20 0.32
ADRA2A P08913 1/20 0.31
ADRA1A P35348 1/20 0.31
TSHR P16473 1/20 0.31
HTR2C P28335 1/20 0.31
P2RY10 O00398 2/20 0.31
GPR34 Q9UPC5 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
SCHEMBL15438932 0.96 ALDH1A1 (0.36) NAAATDP1KMT2AMEN1DGKA
SCHEMBL15438487 0.96 NAAA (0.42) NAAATDP1KMT2AMEN1DGKA
SCHEMBL15438716 0.91 DGKA (0.35) NAAATDP1DGKAALDH1A1POLB
SCHEMBL7208725 0.90 NAAA (0.47) NAAATDP1KMT2AMEN1DGKA
SCHEMBL15438832 0.87 TSHR (0.38) TDP1DGKAALDH1A1ADRA2AADRA1A
SCHEMBL2639986 0.85 NAAA (0.36) NAAATDP1DGKARAD52NPSR1
SCHEMBL15438895 0.84 MAOB (0.32) NAAAKMT2AMEN1ALDH1A1
SCHEMBL27946031 0.84 ALDH1A1 (0.42) NAAAALDH1A1TSHR
SCHEMBL15438164 0.82 MAPT (0.34) NAAAKMT2AMEN1ALDH1A1
SCHEMBL27928017 0.82 ALDH1A1 (0.45) NAAAALDH1A1FAAHTSHR

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