⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2080 | 0.84 | ALDH1A1 (0.35) | — | |
| SCHEMBL27475861 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL29103760 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL28399583 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL28296576 | 0.71 | ALDH1A1 (0.37) | — | |
| SCHEMBL900 | 0.71 | — | — | |
| SCHEMBL5239897 | 0.71 | — | — | |
| SCHEMBL28258823 | 0.70 | ALDH1A1 (0.32) | — | |
| Bromide SCHEMBL8905455 | 0.68 | — | — | |
| SCHEMBL4654442 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2315761-B1 | PHARMACEUTICAL COMPOUNDS | SENTINEL ONCOLOGY LTD (GB) | 2018-07-11 | — | — | EP | disclosed |
| US-8461339-B2 | Pharmaceutical compounds | SENTINEL ONCOLOGY LIMITED (US) | 2013-06-11 | — | — | US | disclosed |
| US-20110130394-A1 | PHARMACEUTICAL COMPOUNDS | SENTINEL ONCOLOGY LIMITED (GB) | 2011-06-02 | — | — | US | disclosed |
| EP-2315761-A1 | PHARMACEUTICAL COMPOUNDS | Sentinel Oncology Limited (GB) | 2011-05-04 | — | — | EP | disclosed |
| WO-2010007374-A1 | PHARMACEUTICAL COMPOUNDS | SENTINEL ONCOLOGY LIMITED (GB) | 2010-01-21 | — | — | WO | disclosed |