SCHEMBL13623250

SCHEMBL13623250

N#CCC(CC#N)(CC#N)CC#N

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL5087892 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL12123460 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL7883058 0.78 ALDH1A1 (0.35) ALDH1A1
SCHEMBL18108828 0.78 ALDH1A1 (0.41) ALDH1A1
Alcohol SCHEMBL11666408 0.71 ALDH1A1 (0.35) ALDH1A1
SCHEMBL1533292 0.67 ALDH1A1 (0.31) ALDH1A1TDP1
SCHEMBL575696 0.67
SCHEMBL17998202 0.67 ALDH1A1 (0.38) ALDH1A1TDP1
SCHEMBL181823 0.67
SCHEMBL686751 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4569559-A1 GLASSY ORGANIC FRAMEWORK ION-CONDUCTIVE MEMBRANES Wisconsin Alumni Research Foundation (US) 2025-06-18 EP disclosed
US-20240055638-A1 GLASSY ORGANIC FRAMEWORK ION-CONDUCTIVE MEMBRANES WISCONSIN ALUMNI RESEARCH FOUNDATION 2024-02-15 US disclosed
WO-2024036130-A1 GLASSY ORGANIC FRAMEWORK ION-CONDUCTIVE MEMBRANES WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2024-02-15 WO disclosed
CN-116505080-B Nonaqueous electrolyte and secondary battery 深圳海辰储能控制技术有限公司 2024-01-30 CN disclosed
CN-116505080-A Nonaqueous electrolyte and secondary battery 深圳海辰储能控制技术有限公司 2023-07-28 CN disclosed
US-10777850-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2020-09-15 US disclosed
US-20190051941-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2019-02-14 US disclosed
US-10177414-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte secondary battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2019-01-08 US disclosed
EP-3098893-B1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY USING SAME MITSUBISHI CHEM CORP (JP) 2017-11-29 EP disclosed
US-20160322669-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2016-11-03 US disclosed
US-9461334-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery using the same MITSUBISHI CHEMICAL CORPORATION (JP) 2016-10-04 US disclosed
US-20160211553-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2016-07-21 US disclosed
US-8859798-B2 Isothiocyanate compounds, pharmaceutical compositions, and uses thereof RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2014-10-14 US disclosed
US-20090291989-A1 ISOTHIOCYANATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2009-11-26 US 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-20090291989-A1 ISOTHIOCYANATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF TST, TREH, NFATC1 ALDH1A1 1832/4885TDP1 3595/4885

“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.