⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9989026 | 0.95 | — | — | |
| SCHEMBL73117 | 0.95 | — | — | |
| SCHEMBL8022297 | 0.91 | TRIM24 (0.50) | — | |
| SCHEMBL118264 | 0.91 | CYP2A6 (0.43) | — | |
| SCHEMBL9627922 | 0.91 | — | — | |
| SCHEMBL9066344 | 0.91 | TRIM24 (0.50) | — | |
| SCHEMBL8998614 | 0.87 | CYP2A6 (0.41) | — | |
| SCHEMBL11352253 | 0.84 | TRIM24 (0.53) | — | |
| SCHEMBL106541 | 0.78 | — | — | |
| SCHEMBL696582 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8106211-B2 | Substituted enaminocarbonyl compounds | BAYER CROPSCIENCE AG (DE) | 2012-01-31 | — | — | US | disclosed |
| US-8084452-B2 | Substituted enaminocarbonyl compounds used as insecticides | BAYER CROPSCIENCE AG (DE) | 2011-12-27 | — | — | US | disclosed |
| US-20100240705-A1 | SUBSTITUTED ENAMINOCARBONYL COMPOUNDS USED AS INSECTICIDES | BAYER CROPSCIENCE AG (DE) | 2010-09-23 | — | — | US | disclosed |