⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL879562 | 0.75 | — | — | |
| SCHEMBL4736009 | 0.75 | — | — | |
| SCHEMBL558033 | 0.75 | — | — | |
| SCHEMBL12352066 | 0.75 | — | — | |
| SCHEMBL4752370 | 0.75 | — | — | |
| SCHEMBL31656490 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL28160401 | 0.73 | NOS3 (0.46) | — | |
| Hydrochloric Acid SCHEMBL27632604 | 0.73 | NOS3 (0.46) | — | |
| Ammonia Solution, Strong SCHEMBL5132889 | 0.73 | NOS3 (0.46) | — | |
| Hydrochloric Acid SCHEMBL29151203 | 0.73 | NUDT1 (0.46) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106674132-A | Preparation method and application of miazines herbicide | 上海书亚医药科技有限公司 | 2017-05-17 | — | — | CN | claimed |
| US-12459922-B2 | PARP7 inhibitors | GILEAD SCIENCES, INC. (US) | 2025-11-04 | — | — | US | disclosed |
| CN-118591537-A | PARP7 inhibitors | 吉利德科学公司 | 2024-09-03 | — | — | CN | disclosed |
| US-20230365529-A1 | PARP7 INHIBITORS | GILEAD SCIENCES, INC. | 2023-11-16 | — | — | US | disclosed |
| CN-106674132-B | A kind of preparation method and application of miazines herbicide | 上海书亚医药科技有限公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-106674132-A | Preparation method and application of miazines herbicide | 上海书亚医药科技有限公司 | 2017-05-17 | — | — | CN | disclosed |
| CN-106674132-A | Preparation method and application of miazines herbicide | 上海书亚医药科技有限公司 | 2017-05-17 | — | — | CN | disclosed |