⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22043384 | 0.78 | LMNA (0.30) | — | |
| SCHEMBL22043111 | 0.78 | TET2 (0.36) | — | |
| SCHEMBL12169342 | 0.76 | NOS3 (0.50) | — | |
| SCHEMBL8580894 | 0.76 | POLB (0.41) | — | |
| SCHEMBL22043387 | 0.75 | GABRP (0.33) | — | |
| SCHEMBL23626192 | 0.73 | — | — | |
| SCHEMBL879191 | 0.73 | — | — | |
| SCHEMBL21718950 | 0.73 | S1PR1 (0.38) | — | |
| SCHEMBL24107257 | 0.73 | NOS3 (0.38) | — | |
| SCHEMBL24928391 | 0.73 | TRPV4 (0.31) | — |
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-11117863-B2 | Pyridone compounds and agricultural and horticultural fungicides containing the same as active ingredients | MITSUI CHEMICALS AGRO, INC. (JP) | 2021-09-14 | — | — | US | disclosed |
| US-20200172486-A1 | PYRIDONE COMPOUNDS AND AGRICULTURAL AND HORTICULTURAL FUNGICIDES CONTAINING THE SAME AS ACTIVE INGREDIENTS | MITSUI CHEMICALS AGRO, INC. (JP) | 2020-06-04 | — | — | US | disclosed |