⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8539525 | 0.73 | — | — | |
| SCHEMBL3024985 | 0.72 | — | — | |
| SCHEMBL10013294 | 0.72 | ALDH1A1 (0.44) | — | |
| SCHEMBL181867 | 0.72 | ALDH1A1 (0.44) | — | |
| SCHEMBL181866 | 0.72 | ALDH1A1 (0.44) | — | |
| SCHEMBL23808308 | 0.69 | — | — | |
| SCHEMBL41702 | 0.69 | — | — | |
| SCHEMBL1820736 | 0.69 | — | — | |
| SCHEMBL10529462 | 0.67 | — | — | |
| SCHEMBL22600443 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1947098-B1 | CYCLIC AMINE COMPOUNDS AND PEST CONTROL AGENT | NIPPON SODA CO (JP) | 2011-11-30 | — | — | EP | claimed |
| EP-0272533-A2 | Substituted phenoxypyridines | BAYER AG (DE) | 1988-06-29 | — | — | EP | claimed |
| US-4797148-A | HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1989-01-10 | — | — | US | disclosed |
| EP-0272533-A2 | Substituted phenoxypyridines | BAYER AG (DE) | 1988-06-29 | — | — | EP | disclosed |