SCHEMBL17697666

SCHEMBL17697666

CCOC(=O)Oc1c(-c2ccccc2)cccc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
ALOX5 P09917 1/20 0.46
BACE1 P56817 1/20 0.45
TYMS P04818 1/20 0.44
ADORA3 P0DMS8 1/20 0.43
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 3/20 0.43
HPGD P15428 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
GAA P10253 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PDCD1 Q15116 1/20 0.42

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
SCHEMBL17720742 0.87 ALOX5 (0.49) LMNAALOX5BACE1ADORA3ALDH1A1
SCHEMBL17697658 0.86 PDE3B (0.44) LMNAALOX5CYP2D6PDCD1CD274
SCHEMBL17720725 0.84 ELANE (0.56) LMNAALOX5BACE1ALDH1A1KDM4E
SCHEMBL1839147 0.83 L3MBTL1 (0.49) LMNAALOX5TYMSADORA3ALDH1A1
SCHEMBL17720743 0.83 ELANE (0.51) LMNAALDH1A1KDM4ECYP3A4MAPK1
SCHEMBL17720723 0.82 ELANE (0.50) LMNAALDH1A1KDM4ECYP3A4MAPK1
SCHEMBL17720721 0.82 ELANE (0.50) LMNAALDH1A1KDM4ECYP3A4MAPK1
SCHEMBL17703427 0.82 ELANE (0.50) LMNAALDH1A1KDM4ECYP3A4MAPK1
SCHEMBL17720749 0.81 BACE1 (0.44) LMNABACE1ALDH1A1KDM4EMEN1
SCHEMBL4259901 0.81 ALDH1A1 (0.48) LMNABACE1ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105324879-B The carbonate products containing xenyl used in nonaqueous electrolytic solution, the electric energy storage device for having used the nonaqueous electrolytic solution and the nonaqueous electrolytic solution 宇部兴产株式会社 2018-07-27 CN claimed
EP-3012896-B1 NONAQUEOUS ELECTROLYTE SOLUTION, ELECTRICITY STORAGE DEVICE USING SAME, AND BIPHENYL GROUP-CONTAINING CARBONATE COMPOUND USED IN SAME UBE INDUSTRIES (JP) 2018-03-28 EP claimed
US-20160126593-A1 NONAQUEOUS ELECTROLYTE SOLUTION, ELECTRICITY STORAGE DEVICE USING SAME, AND BIPHENYL GROUP-CONTAINING CARBONATE COMPOUND USED IN SAME UBE INDUSTRIES, LTD. (JP) 2016-05-05 US claimed
EP-3012896-A1 NONAQUEOUS ELECTROLYTE SOLUTION, ELECTRICITY STORAGE DEVICE USING SAME, AND BIPHENYL GROUP-CONTAINING CARBONATE COMPOUND USED IN SAME UBE Industries, Ltd. (JP) 2016-04-27 EP claimed
CN-105324879-A Nonaqueous electrolyte solution, electricity storage device using same, and biphenyl group-containing carbonate compound used in same UBE INDUSTRIES 2016-02-10 CN claimed
CN-105324879-B The carbonate products containing xenyl used in nonaqueous electrolytic solution, the electric energy storage device for having used the nonaqueous electrolytic solution and the nonaqueous electrolytic solution 宇部兴产株式会社 2018-07-27 CN disclosed
EP-3012896-B1 NONAQUEOUS ELECTROLYTE SOLUTION, ELECTRICITY STORAGE DEVICE USING SAME, AND BIPHENYL GROUP-CONTAINING CARBONATE COMPOUND USED IN SAME UBE INDUSTRIES (JP) 2018-03-28 EP disclosed
US-20160126593-A1 NONAQUEOUS ELECTROLYTE SOLUTION, ELECTRICITY STORAGE DEVICE USING SAME, AND BIPHENYL GROUP-CONTAINING CARBONATE COMPOUND USED IN SAME UBE INDUSTRIES, LTD. (JP) 2016-05-05 US disclosed
US-20160126593-A1 NONAQUEOUS ELECTROLYTE SOLUTION, ELECTRICITY STORAGE DEVICE USING SAME, AND BIPHENYL GROUP-CONTAINING CARBONATE COMPOUND USED IN SAME UBE INDUSTRIES, LTD. (JP) 2016-05-05 US disclosed
US-20160126593-A1 NONAQUEOUS ELECTROLYTE SOLUTION, ELECTRICITY STORAGE DEVICE USING SAME, AND BIPHENYL GROUP-CONTAINING CARBONATE COMPOUND USED IN SAME UBE INDUSTRIES, LTD. (JP) 2016-05-05 US disclosed
EP-3012896-A1 NONAQUEOUS ELECTROLYTE SOLUTION, ELECTRICITY STORAGE DEVICE USING SAME, AND BIPHENYL GROUP-CONTAINING CARBONATE COMPOUND USED IN SAME UBE Industries, Ltd. (JP) 2016-04-27 EP disclosed
CN-105324879-A Nonaqueous electrolyte solution, electricity storage device using same, and biphenyl group-containing carbonate compound used in same UBE INDUSTRIES 2016-02-10 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160126593-A1 NONAQUEOUS ELECTROLYTE SOLUTION, ELECTRICITY STORAGE DEVICE USING SAME, AND BIPHENYL GROUP-CONTAINING CARBONATE COMPOUND USED IN SAME BMI1, KCNN2, CACNA2D4 LMNA 2849/4885ALOX5 4401/4885BACE1 3406/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.