⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13882944 | 1.00 | — | — | |
| SCHEMBL10937564 | 0.76 | — | — | |
| SCHEMBL19004808 | 0.74 | — | — | |
| SCHEMBL8679761 | 0.69 | — | — | |
| SCHEMBL17962151 | 0.69 | — | — | |
| SCHEMBL18088124 | 0.69 | — | — | |
| SCHEMBL12713419 | 0.69 | — | — | |
| SCHEMBL12240898 | 0.69 | — | — | |
| SCHEMBL19284369 | 0.67 | — | — | |
| SCHEMBL10049337 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3611166-A1 | PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT | Mitsui Chemicals Agro, Inc. (JP) | 2020-02-19 | — | — | EP | disclosed |