⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5493426 | 0.73 | LMNA (0.46) | — | |
| SCHEMBL21719748 | 0.71 | — | — | |
| SCHEMBL21479477 | 0.67 | — | — | |
| SCHEMBL24936674 | 0.65 | — | — | |
| SCHEMBL20844219 | 0.65 | — | — | |
| SCHEMBL22350534 | 0.64 | KDM4E (0.45) | — | |
| SCHEMBL24981842 | 0.63 | F2RL1 (0.40) | — | |
| SCHEMBL21718593 | 0.62 | — | — | |
| SCHEMBL21719621 | 0.62 | RHEB (0.31) | — | |
| SCHEMBL13759884 | 0.61 | CYP2C9 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3611165-B1 | PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT | MITSUI CHEMICALS CROP & LIFE SOLUTIONS INC (JP) | 2023-08-16 | — | — | EP | disclosed |
| WO-2019059161-A1 | PYRIDONE COMPOUND AND AGRICULTURAL AND HORTICULTURAL GERMICIDE HAVING SAME AS ACTIVE INGREDIENT | 三井化学アグロ株式会社 | 2019-03-28 | — | — | WO | disclosed |