⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL540551 | 0.67 | — | — | |
| SCHEMBL27989568 | 0.65 | — | — | |
| SCHEMBL7733914 | 0.65 | — | — | |
| SCHEMBL28979861 | 0.63 | — | — | |
| SCHEMBL4451062 | 0.63 | — | — | |
| SCHEMBL65851 | 0.60 | — | — | |
| SCHEMBL7733918 | 0.60 | — | — | |
| SCHEMBL7736644 | 0.60 | — | — | |
| SCHEMBL7733671 | 0.57 | — | — | |
| SCHEMBL668432 | 0.57 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6407041-B1 | HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2002-06-18 | — | — | US | disclosed |
| WO-2000021938-A1 | SUBSTITUTED HERBICIDAL FORMYLAMINOTRIAZINES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-04-20 | — | — | WO | disclosed |