⚠ 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 | |
|---|---|---|---|---|
| Halosulfuron SCHEMBL7588101 | 0.91 | GAA (0.35) | — | |
| Halosulfuron SCHEMBL7577955 | 0.89 | GAA (0.30) | — | |
| Halosulfuron SCHEMBL7579560 | 0.87 | GAA (0.30) | — | |
| Halosulfuron SCHEMBL7586761 | 0.86 | — | — | |
| Rimsulfuron SCHEMBL7585104 | 0.85 | DHODH (0.32) | — | |
| Nicosulfuron SCHEMBL7578685 | 0.84 | DHODH (0.32) | — | |
| Primisulfuron SCHEMBL7581272 | 0.83 | DHODH (0.31) | — | |
| Primisulfuron SCHEMBL7590255 | 0.83 | — | — | |
| Flumipropyn SCHEMBL7581489 | 0.82 | GAA (0.34) | — | |
| Flumipropyn SCHEMBL7580491 | 0.81 | PPOX (0.40) | — |
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 |