⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5348678 | 0.65 | DAO (0.35) | — | |
| SCHEMBL630634 | 0.65 | HDAC6 (0.41) | — | |
| Hydrochloric Acid SCHEMBL5409217 | 0.63 | DAO (0.33) | — | |
| Hydrochloric Acid SCHEMBL7988951 | 0.62 | HDAC6 (0.40) | — | |
| SCHEMBL30659527 | 0.62 | — | — | |
| SCHEMBL14954301 | 0.61 | — | — | |
| SCHEMBL13656487 | 0.61 | TSHR (0.43) | — | |
| SCHEMBL75926 | 0.61 | — | — | |
| SCHEMBL7112624 | 0.61 | — | — | |
| SCHEMBL1897903 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-221938740-U | Full-automatic labeller is with covering mark mechanism | 东莞市伟创自动化设备有限公司 | 2024-11-01 | — | — | CN | disclosed |