⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17669638 | 0.74 | — | — | |
| SCHEMBL9820328 | 0.60 | — | — | |
| SCHEMBL10653498 | 0.56 | — | — | |
| SCHEMBL9820378 | 0.54 | — | — | |
| SCHEMBL24597196 | 0.54 | — | — | |
| SCHEMBL9820356 | 0.52 | — | — | |
| SCHEMBL2282940 | 0.52 | — | — | |
| SCHEMBL1973309 | 0.50 | — | — | |
| SCHEMBL10834245 | 0.49 | — | — | |
| SCHEMBL1474 | 0.47 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116969944-A | Ethylamino-substituted tricyclic heterocyclic compounds and compositions, formulations and uses thereof | 北京福元医药股份有限公司 | 2023-10-31 | — | — | CN | disclosed |
| CN-115536660-A | Benzylamino-substituted heteropolycyclic compounds, compositions, formulations and uses thereof | 北京福元医药股份有限公司 | 2022-12-30 | — | — | CN | disclosed |