⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18683520 | 0.83 | — | — | |
| SCHEMBL2594264 | 0.71 | — | — | |
| SCHEMBL14174958 | 0.67 | — | — | |
| SCHEMBL4620921 | 0.65 | — | — | |
| SCHEMBL6587637 | 0.65 | — | — | |
| SCHEMBL14447406 | 0.65 | — | — | |
| SCHEMBL7091055 | 0.65 | — | — | |
| SCHEMBL17293370 | 0.65 | — | — | |
| SCHEMBL11980671 | 0.65 | — | — | |
| SCHEMBL27928433 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022112351-A1 | HERBICIDAL MALONAMIDES | BASF SE (DE) | 2022-06-02 | — | — | WO | disclosed |
| WO-2021209268-A1 | BETA-LACTAMS AND THEIR USE AS HERBICIDES | BASF SE (DE) | 2021-10-21 | — | — | WO | disclosed |