⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18121933 | 0.69 | — | — | |
| SCHEMBL10145815 | 0.69 | — | — | |
| SCHEMBL22916961 | 0.69 | — | — | |
| SCHEMBL9216352 | 0.67 | — | — | |
| SCHEMBL10145803 | 0.65 | ALDH1A1 (0.36) | — | |
| SCHEMBL12132412 | 0.65 | — | — | |
| SCHEMBL408921 | 0.64 | — | — | |
| SCHEMBL8277477 | 0.64 | — | — | |
| SCHEMBL21253977 | 0.63 | — | — | |
| SCHEMBL347846 | 0.62 | — | — |
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-2019101513-A1 | HERBICIDAL PYRIDYLETHERS | BASF SE (DE) | 2019-05-31 | — | — | WO | disclosed |
| WO-2019101551-A1 | HERBICIDAL PHENYLETHERS | BASF SE (DE) | 2019-05-31 | — | — | WO | disclosed |