⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27615070 | 0.73 | — | — | |
| SCHEMBL7024290 | 0.71 | — | — | |
| SCHEMBL77645 | 0.65 | — | — | |
| SCHEMBL10526818 | 0.65 | — | — | |
| SCHEMBL4932569 | 0.62 | LIPA (0.38) | — | |
| SCHEMBL8378531 | 0.62 | — | — | |
| SCHEMBL981309 | 0.62 | — | — | |
| SCHEMBL430486 | 0.60 | THRB (0.35) | — | |
| SCHEMBL11924858 | 0.60 | — | — | |
| SCHEMBL6151435 | 0.60 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100160165-A1 | AQUEOUS ACTIVE INGREDIENT CONCENTRATE HAVING AN HERBICIDAL EFFECT | BASF SE (DE) | 2010-06-24 | — | — | US | disclosed |
| EP-2048947-B1 | AQUEOUS ACTIVE INGREDIENT CONCENTRATE HAVING AN HERBICIDAL EFFECT | BASF SE (DE) | 2009-12-02 | — | — | EP | disclosed |
| EP-2048947-A2 | AQUEOUS ACTIVE INGREDIENT CONCENTRATE HAVING AN HERBICIDAL EFFECT | BASF SE (DE) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008015280-A2 | AQUEOUS ACTIVE INGREDIENT CONCENTRATE HAVING AN HERBICIDAL EFFECT | BASF SE (DE) | 2008-02-07 | — | — | WO | disclosed |