⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11000474 | 0.76 | LMNA (0.48) | — | |
| SCHEMBL1018060 | 0.73 | — | — | |
| SCHEMBL19133549 | 0.72 | — | — | |
| SCHEMBL148860 | 0.72 | — | — | |
| SCHEMBL1019499 | 0.71 | — | — | |
| SCHEMBL10345019 | 0.71 | — | — | |
| SCHEMBL12971185 | 0.69 | — | — | |
| SCHEMBL179922 | 0.69 | — | — | |
| SCHEMBL15403609 | 0.67 | — | — | |
| SCHEMBL248209 | 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 84 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1192141-A1 | 1,4-DIAZACYCLOHEPTANE DERIVATIVES AS NEUROPROTECTIVE AGENTS | AstraZeneca UK Limited (GB) | 2002-04-03 | — | — | EP | claimed |
| WO-2000078736-A1 | 1,4-DIAZACYCLOHEPTANE DERIVATIVES AS NEUROPROTECTIVE AGENTS | ASTRAZENECA UK LIMITED (GB) | 2000-12-28 | — | — | WO | claimed |
| US-20220000117-A1 | METHOD FOR CONTROLLING DISEASES IN SMALL GRAIN CEREALS, SEED OF SMALL GRAIN CEREALS, AND METHOD FOR SUPPRESSING LODGING DAMAGE IN SMALL GRAIN CEREALS | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2022-01-06 | — | — | US | disclosed |
| EP-3878278-A1 | METHOD FOR CONTROLLING DISEASES IN SMALL GRAIN CEREALS, SEED OF SMALL GRAIN CEREALS, AND METHOD FOR SUPPRESSING LODGING DAMAGE IN SMALL GRAIN CEREALS | Kumiai Chemical Industry Co., Ltd. (JP) | 2021-09-15 | — | — | EP | disclosed |
| CN-112955008-A | Method for preventing and treating wheat diseases, wheat seeds and method for suppressing lodging loss of wheat | 组合化学工业株式会社 | 2021-06-11 | — | — | CN | disclosed |
| CN-106414414-B | Process for producing trione compound | 组合化学工业株式会社 | 2020-07-14 | — | — | CN | disclosed |
| CN-105198861-B | 6- acyl group -1,2,4- triazine -3,5- derovatives and herbicide | FMC公司 | 2019-11-22 | — | — | CN | disclosed |
| US-20190047968-A1 | 6-ACYL-1,2,4-TRIAZINE-3,5-DIONE DERIVATIVE AND HERBICIDES | FMC CORP (US) | 2019-02-14 | — | — | US | disclosed |
| US-10081608-B2 | 6-acyl-1,2,4-triazine-3,5-dione derivative and herbicides | FMC CORPORATION (US) | 2018-09-25 | — | — | US | disclosed |
| EP-2792667-B1 | DIPHENYLAMINE COMPOUND AND METHOD FOR PRODUCING SAME | KUMIAI CHEMICAL INDUSTRY CO (JP) | 2018-02-07 | — | — | EP | disclosed |
| CN-104011010-B | Bisaniline compounds and its manufacture method | 组合化学工业株式会社 | 2017-11-28 | — | — | CN | disclosed |
| WO-2007147888-A1 | MALONONITRILE COMPOUNDS | BASF SE (DE) | 2007-12-27 | — | — | WO | disclosed |
| CN-101039922-A | 3-triazolylphenyl sulfide derivative and insecticide/acaricide/nematicide containing the same as active ingredient | KUMIAI CHEMICAL INDUSTRY CO (JP) | 2007-09-19 | — | — | CN | disclosed |
| EP-1803712-A1 | 3-TRIAZOLYLPHENYL SULFIDE DERIVATIVE AND INSECTICIDE/ACARICIDE/NEMATICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2007-07-04 | — | — | EP | disclosed |
| US-20070112068-A1 | Nitrile compound and its use in pest control | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2007-05-17 | — | — | US | disclosed |
| CN-1898200-A | Nitrile compound and its pest control use | SUMITOMO CHEMICAL CO (JP) | 2007-01-17 | — | — | CN | disclosed |
| EP-1697311-A1 | NITRILE COMPOUND AND ITS USE IN PEST CONTROL | Sumitomo Chemical Company, Limited (JP) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005063694-A1 | NITRILE COMPOUND AND ITS USE IN PEST CONTROL | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2005-07-14 | — | — | WO | disclosed |
| EP-1192141-A1 | 1,4-DIAZACYCLOHEPTANE DERIVATIVES AS NEUROPROTECTIVE AGENTS | AstraZeneca UK Limited (GB) | 2002-04-03 | — | — | EP | disclosed |
| WO-2000078736-A1 | 1,4-DIAZACYCLOHEPTANE DERIVATIVES AS NEUROPROTECTIVE AGENTS | ASTRAZENECA UK LIMITED (GB) | 2000-12-28 | — | — | WO | disclosed |