⚠ 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 | |
|---|---|---|---|---|
| Dinotefuran SCHEMBL19019789 | 1.00 | — | — | |
| Dinotefuran SCHEMBL29992195 | 0.87 | NAMPT (0.34) | — | |
| Dinotefuran SCHEMBL182310 | 0.87 | NAMPT (0.34) | — | |
| SCHEMBL8545417 | 0.87 | PARP1 (0.33) | — | |
| Dinotefuran SCHEMBL26337 | 0.87 | NAMPT (0.34) | — | |
| Dinotefuran SCHEMBL28442208 | 0.87 | NAMPT (0.34) | — | |
| Dinotefuran SCHEMBL7762050 | 0.87 | NAMPT (0.34) | — | |
| Dinotefuran SCHEMBL237819 | 0.87 | NAMPT (0.34) | — | |
| SCHEMBL8545413 | 0.87 | PARP1 (0.33) | — | |
| Dinotefuran SCHEMBL23070869 | 0.85 | NAMPT (0.33) | — |
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-3183968-A1 | METHODS AND MEANS FOR THE ERADICATION OF FLEAS | Ceva Sante Animale (FR) | 2017-06-28 | — | — | EP | disclosed |