⚠ 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 | |
|---|---|---|---|---|
| Bispyribac SCHEMBL7587439 | 0.87 | — | — | |
| Flumiciorac-Pentyl SCHEMBL7588194 | 0.81 | PPOX (0.40) | — | |
| Flumipropyn SCHEMBL7576016 | 0.81 | NPSR1 (0.36) | — | |
| Flumipropyn SCHEMBL7589329 | 0.80 | PPOX (0.43) | — | |
| Flumioxazin SCHEMBL7581487 | 0.79 | — | — | |
| Flumipropyn SCHEMBL38980 | 0.79 | PPOX (0.54) | — | |
| Flumipropyn SCHEMBL29413729 | 0.79 | PPOX (0.54) | — | |
| Halosulfuron SCHEMBL7588101 | 0.77 | GAA (0.35) | — | |
| Flumipropyn SCHEMBL7578875 | 0.76 | PPOX (0.34) | — | |
| Flumipropyn SCHEMBL7594476 | 0.74 | GAA (0.36) | — |
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 |