⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21719207 | 0.83 | MKNK1 (0.36) | — | |
| SCHEMBL21719039 | 0.83 | — | — | |
| SCHEMBL21719300 | 0.83 | UHRF1 (0.31) | — | |
| SCHEMBL21718464 | 0.81 | CNR1 (0.30) | — | |
| SCHEMBL21718463 | 0.80 | — | — | |
| SCHEMBL21719205 | 0.78 | KDM4E (0.30) | — | |
| SCHEMBL21721313 | 0.69 | — | — | |
| SCHEMBL22043393 | 0.69 | HDAC8 (0.32) | — | |
| SCHEMBL21719211 | 0.69 | AAK1 (0.32) | — | |
| SCHEMBL21718959 | 0.67 | CNR2 (0.35) | — |
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-11178870-B2 | Pyridone compounds and agricultural and horticultural fungicides containing the same as active ingredients | MITSUI CHEMICALS AGRO, INC. (JP) | 2021-11-23 | — | — | US | disclosed |
| US-20200045968-A1 | PYRIDONE COMPOUNDS AND AGRICULTURAL AND HORTICULTURAL FUNGICIDES CONTAINING THE SAME AS ACTIVE INGREDIENTS | MITSUI CHEMICALS AGRO, INC. (JP) | 2020-02-13 | — | — | US | disclosed |