⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9435873 | 0.93 | TAAR1 (0.65) | — | |
| SCHEMBL1309062 | 0.86 | — | — | |
| SCHEMBL20135772 | 0.85 | TAAR1 (0.73) | — | |
| SCHEMBL20146704 | 0.85 | TAAR1 (0.73) | — | |
| SCHEMBL6734915 | 0.83 | TAAR1 (0.70) | — | |
| SCHEMBL8571535 | 0.83 | TAAR1 (0.70) | — | |
| SCHEMBL7116263 | 0.83 | TAAR1 (0.70) | — | |
| SCHEMBL550841 | 0.82 | — | — | |
| SCHEMBL244450 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL1535324 | 0.80 | TAAR1 (0.79) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117832373-A | Self-assembled monomolecular film composite zinc electrode, preparation method thereof and water-based zinc ion battery | 中国人民解放军国防科技大学 | 2024-04-05 | — | — | CN | disclosed |
| EP-1682113-B1 | INHIBITOR IMAGING AGENTS | GE HEALTHCARE LTD (GB) | 2008-01-23 | — | — | EP | disclosed |
| US-20070104644-A1 | Inhibitor imaging agents | CUTHBERTSON ALAN | 2007-05-10 | — | — | US | disclosed |
| EP-1682113-A1 | INHIBITOR IMAGING AGENTS | GE Healthcare Limited (GB) | 2006-07-26 | — | — | EP | disclosed |
| WO-2005049005-A1 | INHIBITOR IMAGING AGENTS | GE HEALTHCARE LIMITED (GB) | 2005-06-02 | — | — | WO | disclosed |