⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5899081 | 0.75 | — | — | |
| SCHEMBL29987273 | 0.67 | — | — | |
| SCHEMBL28945983 | 0.67 | — | — | |
| SCHEMBL27572 | 0.64 | — | — | |
| SCHEMBL21508093 | 0.62 | — | — | |
| SCHEMBL11926769 | 0.59 | — | — | |
| SCHEMBL490333 | 0.59 | — | — | |
| SCHEMBL257414 | 0.59 | — | — | |
| SCHEMBL5534445 | 0.58 | — | — | |
| SCHEMBL12191549 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010093595-A1 | FUNGICIDAL 2-PYRIDONES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-08-19 | — | — | WO | disclosed |