⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL436822 | 0.67 | — | — | |
| SCHEMBL4151356 | 0.67 | — | — | |
| SCHEMBL1472 | 0.59 | — | — | |
| SCHEMBL4120442 | 0.59 | — | — | |
| Propene SCHEMBL451807 | 0.56 | — | — | |
| SCHEMBL7601555 | 0.56 | — | — | |
| SCHEMBL8364790 | 0.56 | — | — | |
| Propene SCHEMBL1737 | 0.54 | — | — | |
| Propene SCHEMBL193 | 0.54 | — | — | |
| SCHEMBL867 | 0.54 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7307184-B2 | Processes for preparing oxazolidinone derivatives of β-hydroxyethlamine compounds and for preparing β-hydroxyethlamine compounds | KANEKA CORPORATION (JP) | 2007-12-11 | — | — | US | disclosed |
| EP-1432686-B1 | TETRAHYDROISOCHINOLINES, THEIR PRODUCTION AND THE USE THEREOF AS ANALGESICS | BAYER HEALTHCARE AG (DE) | 2005-06-29 | — | — | EP | disclosed |
| EP-1539721-A1 | DIBENZOXAZEPINE | Bayer HealthCare AG (DE) | 2005-06-15 | — | — | EP | disclosed |
| US-20040181074-A1 | Process for producing oxazolidinone derivative of beta-hydroxyethylamine compound and for producing beta-hydroxyethlamine compound | KANEKA CORPORATION (JP) | 2004-09-16 | — | — | US | disclosed |
| EP-1432686-A1 | TETRAHYDROISOCHINOLINES, THEIR PRODUCTION AND THE USE THEREOF AS ANALGESICS | Bayer HealthCare AG (DE) | 2004-06-30 | — | — | EP | disclosed |
| WO-2004033437-A1 | DIBENZOXAZEPINE | BAYER HEALTHCARE AG (DE) | 2004-04-22 | — | — | WO | disclosed |
| EP-1403257-A1 | PROCESSES FOR PRODUCING OXAZOLIDINONE DERIVATIVE OF BETA-HYDROXYETHYLAMINE COMPOUND AND FOR PRODUCING BETA-HYDROXYETHYLAMINE COMPOUND | KANEKA CORPORATION (JP) | 2004-03-31 | — | — | EP | disclosed |
| WO-2003029221-A1 | TETRAHYDROISOCHINOLINES, THEIR PRODUCTION AND THE USE THEREOF AS ANALGESICS | BAYER HEALTHCARE AG (DE) | 2003-04-10 | — | — | WO | disclosed |