⚠ 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 | |
|---|---|---|---|---|
| Flumioxazin SCHEMBL7588821 | 0.94 | — | — | |
| Flumioxazin SCHEMBL7589118 | 0.89 | HPGD (0.30) | — | |
| Flumioxazin SCHEMBL7580212 | 0.86 | — | — | |
| Flumioxazin SCHEMBL7189384 | 0.85 | GRM7 (0.36) | — | |
| Metribuzin SCHEMBL7578526 | 0.81 | — | — | |
| Flumioxazin SCHEMBL7577267 | 0.80 | — | — | |
| Flumipropyn SCHEMBL7577519 | 0.80 | PPOX (0.33) | — | |
| Flumioxazin SCHEMBL7579042 | 0.79 | GRM7 (0.36) | — | |
| Flumioxazin SCHEMBL7584142 | 0.78 | GRM7 (0.34) | — | |
| Flumioxazin SCHEMBL7578101 | 0.77 | GRM7 (0.32) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020004457-A1 | Herbicidal composition | SYNGENTA PARTICIPATIONS AG (CH) | 2002-01-10 | — | — | US | disclosed |