⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1168086 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL2143726 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL11478654 | 0.74 | ALDH1A1 (0.30) | — | |
| SCHEMBL2731086 | 0.71 | — | — | |
| SCHEMBL6829129 | 0.70 | ALDH1A1 (0.42) | — | |
| SCHEMBL51611 | 0.70 | ALDH1A1 (0.42) | — | |
| SCHEMBL11155134 | 0.68 | CRHBP (0.39) | — | |
| SCHEMBL6831492 | 0.68 | ALDH1A1 (0.50) | — | |
| SCHEMBL5847104 | 0.67 | — | — | |
| SCHEMBL1078246 | 0.66 | ALDH1A1 (0.38) | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0210446-A2 | Nitro- and cyanoguanidines as selective preemergence herbicides and plant defoliants | AMERICAN CYANAMID COMPANY (US) | 1987-02-04 | — | — | EP | claimed |
| US-9249088-B2 | Continuous production and reaction of a diazo compound | DPX HOLDINGS B.V. (NL) | 2016-02-02 | — | — | US | disclosed |
| EP-2635548-B1 | CONTINUOUS PRODUCTION AND REACTION OF A DIAZO COMPOUND | DPX HOLDINGS BV (NL) | 2014-12-17 | — | — | EP | disclosed |
| US-20140100360-A1 | CONTINUOUS PRODUCTION AND REACTION OF A DIAZO COMPOUND | DSM FINE CHEMICALS AUSTRIA NFG. GMBH & CO KG (AT) | 2014-04-10 | — | — | US | disclosed |
| US-6680408-B2 | REACTING S-METHYL NITROISOTHIOUREA WITH ALPHA-ETHYLBENZYLAMINE IN THE PRESENCE OF WATER AND ETHANOL MIXTURES TO FORM 1-(ALPHA-ETHYLBENZYL)-3-NITROGUANIDINE, USED AS PREEMERGENCE HERBICIDES | BAYER CROPSCIENCE LP | 2004-01-20 | — | — | US | disclosed |
| US-20030236168-A1 | PROCESSES FOR THE PREPARATION OF ALPHA-SUBSTITUTED BENZYLNITROGUANIDINES | BAYER CORPORATION | 2003-12-25 | — | — | US | disclosed |
| US-5175365-A | Preemergence herbicide 1- alpha-ethylbenzyl!-3-nitroguanidine | AMERICAN CYANAMID COMPANY (US) | 1992-12-29 | — | — | US | disclosed |
| US-4995903-A | Alkyl-, Alkenyl- and alkynylnitroguanidines as cytokinin plant growth regulants | AMERICAN CYANAMID COMPANY (US) | 1991-02-26 | — | — | US | disclosed |
| US-4944788-A | Substituted nitro and cyanoguanidines and their use for increasing crop yields | AMERICAN CYANAMID COMPANY (US) | 1990-07-31 | — | — | US | disclosed |
| US-4822408-A | Alkyl-, alkenyl- and alkynylnitroguanidines as cytokinin plant growth regulants | AMERICAN CYANAMID COMPANY (US) | 1989-04-18 | — | — | US | disclosed |
| US-4804780-A | PLANT GROWTH REGULATORS | AMERICAN CYANAMID COMPANY (US) | 1989-02-14 | — | — | US | disclosed |
| US-4742006-A | SELECTIVE | KERNFORSCHUNGSANLAGE JULICH GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-05-03 | — | — | US | disclosed |
| EP-0113070-B1 | THE USE OF SUBSTITUTED NITRO AND CYANOGUANIDINES FOR INCREASING CROP YIELD | AMERICAN CYANAMID COMPANY (US) | 1988-01-13 | — | — | EP | disclosed |
| US-4677226-A | Alkyl-, alkenyl- and alkynylnitroguanidines as cytokinin plant growth regulants | AMERICAN CYANAMID COMPANY (US) | 1987-06-30 | — | — | US | disclosed |
| EP-0212518-A2 | Fermentation process for the production or enrichment of fructose with respect to glucose, and suitable Zymomonas mobilis mutants therefor | FORSCHUNGSZENTRUM JÜLICH GMBH (DE) | 1987-03-04 | — | — | EP | disclosed |
| EP-0210446-A2 | Nitro- and cyanoguanidines as selective preemergence herbicides and plant defoliants | AMERICAN CYANAMID COMPANY (US) | 1987-02-04 | — | — | EP | disclosed |
| US-4639268-A | Nitro- and cyanoguanidines as selective preemergence herbicides and plant defoliants | AMERICAN CYANAMID COMPANY (US) | 1987-01-27 | — | — | US | disclosed |
| EP-0189579-A1 | Substituted nitro and cyanoguanidines and their use for increasing crop yield | AMERICAN CYANAMID COMPANY (US) | 1986-08-06 | — | — | EP | disclosed |
| US-4594092-A | Cytokinin-like response | AMERICAN CYANAMID COMPANY (US) | 1986-06-10 | — | — | US | disclosed |
| EP-0113070-A1 | The use of substituted nitro and cyanoguanidines for increasing crop yield | AMERICAN CYANAMID COMPANY (US) | 1984-07-11 | — | — | EP | disclosed |