⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2413066 | 0.69 | — | — | |
| SCHEMBL7014314 | 0.68 | — | — | |
| SCHEMBL9572747 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL6368777 | 0.65 | — | — | |
| SCHEMBL27283374 | 0.64 | KDM4E (0.32) | — | |
| SCHEMBL18282566 | 0.62 | — | — | |
| SCHEMBL30026724 | 0.62 | — | — | |
| SCHEMBL9156516 | 0.62 | — | — | |
| SCHEMBL4322516 | 0.62 | — | — | |
| SCHEMBL30963929 | 0.62 | — | — |
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-115135648-B | Dihydronaphthyridones, preparation method and medical application thereof | 劲方医药科技(上海)有限公司 | 2024-02-09 | — | — | CN | disclosed |
| CN-115135648-A | Dihydronaphthyridinone compounds, preparation method and medical application thereof | 劲方医药科技(上海)有限公司 | 2022-09-30 | — | — | CN | disclosed |