⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL434808 | 0.82 | ALDH1A1 (0.34) | — | |
| SCHEMBL14844780 | 0.79 | KDM4E (0.31) | — | |
| SCHEMBL121098 | 0.67 | — | — | |
| SCHEMBL29419134 | 0.67 | — | — | |
| SCHEMBL2565987 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL15271115 | 0.67 | KCNQ3 (0.30) | — | |
| SCHEMBL232214 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL13026050 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL487329 | 0.66 | ALDH1A1 (0.36) | — | |
| SCHEMBL487384 | 0.66 | ALDH1A1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2004636-B1 | Substituted enaminocarbonyl compounds used as insecticides | BAYER IP GMBH (DE) | 2015-04-22 | — | — | EP | disclosed |
| EP-2004636-A1 | SUBSTITUTED ENAMINOCARBONYL COMPOUNDS USED AS INSECTICIDES | Bayer CropScience AG (DE) | 2008-12-24 | — | — | EP | disclosed |
| WO-2007115646-A1 | SUBSTITUTED ENAMINOCARBONYL COMPOUNDS USED AS INSECTICIDES | BAYER CROPSCIENCE AG (DE) | 2007-10-18 | — | — | WO | disclosed |