⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15895190 | 0.81 | — | — | |
| SCHEMBL3586153 | 0.81 | — | — | |
| SCHEMBL19831178 | 0.79 | RXRA (0.35) | — | |
| SCHEMBL22031726 | 0.79 | RXRA (0.35) | — | |
| SCHEMBL9262212 | 0.78 | BACE1 (0.32) | — | |
| SCHEMBL487436 | 0.77 | TLR7 (0.33) | — | |
| SCHEMBL7996511 | 0.75 | CYP11B1 (0.33) | — | |
| SCHEMBL17784993 | 0.75 | VRK1 (0.34) | — | |
| SCHEMBL487400 | 0.75 | NTRK1 (0.33) | — | |
| SCHEMBL28754352 | 0.73 | GABRP (0.43) | — |
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 5 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 |
| 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 |
| US-5475112-A | Reducing a substituted trichloromethylpyridine derivative in presence of a proton donor and solvent | ISHIHARA SANGYO KAISHA LTD. (JP) | 1995-12-12 | — | — | US | disclosed |
| EP-0512436-A1 | Method for producing substituted pyridine derivatives | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1992-11-11 | — | — | EP | disclosed |