SCHEMBL15438895

SCHEMBL15438895

C#CCCCOC(=O)CP(=O)(OC)OC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.32
MAPT P10636 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAOA P21397 1/20 0.32
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
NAAA Q02083 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
SCHEMBL15438164 0.95 MAPT (0.34) MAOBMAPTCYP1A2CYP2D6CYP2C9
SCHEMBL15438182 0.90 MEN1 (0.35) MEN1KMT2A
SCHEMBL15438145 0.84 TSHR (0.38) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL15438487 0.84 NAAA (0.42) MEN1ALDH1A1CYP3A4KMT2ANAAA
SCHEMBL15439233 0.84 NAAA (0.38) MEN1ALDH1A1KMT2ANAAA
SCHEMBL15438932 0.80 ALDH1A1 (0.36) MEN1ALDH1A1KMT2ANAAA
SCHEMBL15438716 0.80 DGKA (0.35) MAPTCYP2C19ALDH1A1CYP3A4NAAA
SCHEMBL15438092 0.80 TSHR (0.37) MAPTCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL7208725 0.79 NAAA (0.47) CYP1A2CYP2D6CYP2C19MEN1ALDH1A1
SCHEMBL15438912 0.79 TSHR (0.37) CYP1A2CYP2D6ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9384906-B2 Non-aqueous electrolyte solution and electricity-storage device using same UBE INDUSTRIES, LTD. (JP) 2016-07-05 US disclosed
US-20140030610-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY-STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD (JP) 2014-01-30 US disclosed