⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23178565 | 0.82 | — | — | |
| SCHEMBL8450440 | 0.74 | — | — | |
| SCHEMBL2258330 | 0.73 | — | — | |
| SCHEMBL8445941 | 0.61 | — | — | |
| SCHEMBL2075097 | 0.60 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL1428036 | 0.59 | — | — | |
| SCHEMBL7041416 | 0.59 | — | — | |
| SCHEMBL6340954 | 0.59 | — | — | |
| SCHEMBL961656 | 0.59 | — | — | |
| SCHEMBL7039177 | 0.59 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0942909-A1 | BICYCLIC AMINE DERIVATIVES | ZENECA LIMITED (GB) | 1999-09-22 | — | — | EP | disclosed |
| WO-1998022463-A1 | BICYCLIC AMINE DERIVATIVES | ZENECA LIMITED (GB) | 1998-05-28 | — | — | WO | disclosed |