⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18381558 | 1.00 | — | — | |
| SCHEMBL30725538 | 0.85 | — | — | |
| SCHEMBL218052 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL27915759 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL25357793 | 0.78 | — | — | |
| SCHEMBL30626416 | 0.78 | — | — | |
| SCHEMBL29267478 | 0.74 | — | — | |
| SCHEMBL31607155 | 0.72 | — | — | |
| SCHEMBL32457366 | 0.72 | — | — | |
| SCHEMBL30547157 | 0.72 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116134022-B | ATR inhibitors and uses thereof | 上海德琪医药科技有限公司 | 2025-03-18 | — | — | CN | disclosed |
| CN-116478098-A | Polyimide precursor, polyimide, preparation method and application thereof | 深圳先进电子材料国际创新研究院 | 2023-07-25 | — | — | CN | disclosed |
| CN-116134022-A | ATR inhibitors and uses thereof | 上海德琪医药科技有限公司 | 2023-05-16 | — | — | CN | disclosed |
| EP-4175948-A1 | ATR INHIBITORS AND USES THEREOF | ANTENGENE DISCOVERY LIMITED (CN) | 2023-05-10 | — | — | EP | disclosed |