SCHEMBL15438862

SCHEMBL15438862

C#CC(C)(C)OC(=O)CP(=O)(Oc1ccc(F)cc1)Oc1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.42
HPGD P15428 2/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ANO1 Q5XXA6 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
MMP13 P45452 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAOB P27338 1/20 0.31
FDPS P14324 1/20 0.30
GAA P10253 1/20 0.30
KCNQ4 P56696 1/20 0.30
KCNQ5 Q9NR82 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
SCHEMBL15438749 0.88 ELANE (0.43) ELANEL3MBTL1KMT2AMMP13GAA
SCHEMBL15438109 0.86 ELANE (0.40) ELANEL3MBTL1CYP2C9CYP2C19ALDH1A1
SCHEMBL15439157 0.81 POLB (0.41) ELANEHPGDANO1GAAKCNQ4
SCHEMBL15438297 0.78 NPC1 (0.38) HPGDMAPK1SMN1; SMN2KMT2ACYP1A2
SCHEMBL15438096 0.76 HPGD (0.34) HPGDMAPK1SMN1; SMN2KMT2ACYP1A2
SCHEMBL15438423 0.74 ELANE (0.38) ELANE
SCHEMBL15438678 0.71 TSHR (0.41) ELANE
SCHEMBL15438870 0.70 ELANE (0.37) ELANE
SCHEMBL1905315 0.70 ALDH1A1 (0.44) L3MBTL1ALDH1A1
SCHEMBL15438758 0.70 ACHE (0.38) ELANE

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