⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13055879 | 0.84 | GAA (0.33) | — | |
| SCHEMBL14311482 | 0.84 | — | — | |
| SCHEMBL3381416 | 0.80 | — | — | |
| SCHEMBL29169585 | 0.76 | GAA (0.33) | — | |
| SCHEMBL14364493 | 0.76 | ALDH1A1 (0.34) | — | |
| SCHEMBL14311484 | 0.75 | — | — | |
| SCHEMBL14364491 | 0.75 | GAA (0.32) | — | |
| SCHEMBL4290776 | 0.75 | — | — | |
| SCHEMBL14364501 | 0.75 | GAA (0.33) | — | |
| SCHEMBL3736237 | 0.75 | ALDH1A1 (0.39) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8404618-B2 | Herbicidal composition | SYNGENTA LIMITED (GB) | 2013-03-26 | — | — | US | disclosed |
| US-8404618-B2 | Herbicidal composition | SYNGENTA LIMITED (GB) | 2013-03-26 | — | — | US | disclosed |
| EP-1364946-B1 | ISOXAZOLINE DERIVATIVE AND HERBICIDE COMPRISING THE SAME AS ACTIVE INGREDIENT | KUMIAI CHEMICAL INDUSTRY CO (JP) | 2010-11-24 | — | — | EP | disclosed |
| US-7833939-B2 | Herbicide compositions | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2010-11-16 | — | — | US | disclosed |
| EP-2186410-A1 | Isoxazoline derivative and herbicide comprising the same as active ingredient | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2010-05-19 | — | — | EP | disclosed |
| EP-1755397-B1 | HERBICIDAL COMPOSITION | SYNGENTA PARTICIPATIONS AG (CH) | 2008-01-09 | — | — | EP | disclosed |
| US-20070259786-A1 | Herbicidal Composition | SYNGENTA CROP PROTECTION, INC. (US) | 2007-11-08 | — | — | US | disclosed |
| US-20070259786-A1 | Herbicidal Composition | SYNGENTA CROP PROTECTION, INC. (US) | 2007-11-08 | — | — | US | disclosed |
| US-7238689-B2 | Isoxazoline derivative and herbicide comprising the same as active ingredient | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 2007-07-03 | — | — | US | disclosed |
| US-20050256004-A1 | Herbicide compositions | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2005-11-17 | — | — | US | disclosed |
| US-20040110749-A1 | Isoxazoline derivative and herbicide comprising the same as active ingredient | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2004-06-10 | — | — | US | disclosed |
| EP-1364946-A1 | ISOXAZOLINE DERIVATIVE AND HERBICIDE COMPRISING THE SAME AS ACTIVE INGREDIENT | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2003-11-26 | — | — | EP | disclosed |