⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22993 | 0.71 | — | — | |
| SCHEMBL28184335 | 0.71 | — | — | |
| SCHEMBL18458273 | 0.71 | — | — | |
| SCHEMBL30808383 | 0.71 | — | — | |
| SCHEMBL22434925 | 0.71 | — | — | |
| SCHEMBL27879484 | 0.71 | — | — | |
| SCHEMBL708361 | 0.71 | — | — | |
| SCHEMBL29868053 | 0.71 | — | — | |
| Charcoal, Activated SCHEMBL10756751 | 0.68 | — | — | |
| Iodide SCHEMBL8624442 | 0.68 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0057777-A1 | Dibenzoxazonine, dibenzoxazecine, dibenzoxaazacycloundecane derivatives and their corresponding thia- and aza derivatives, their preparation and pharmaceutical compositions | AKZO N.V. (NL) | 1982-08-18 | — | — | EP | disclosed |