⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28257099 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL5133480 | 0.94 | — | — | |
| SCHEMBL29131276 | 0.82 | — | — | |
| SCHEMBL29176423 | 0.74 | — | — | |
| SCHEMBL28172553 | 0.74 | — | — | |
| SCHEMBL28111439 | 0.73 | — | — | |
| SCHEMBL27974913 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL9235952 | 0.70 | — | — | |
| SCHEMBL11850056 | 0.70 | — | — | |
| SCHEMBL1546956 | 0.67 | — | — |
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-110317212-A | The synthesis of polycyclic carbamoylpyridone compound | 吉利德科学公司 | 2019-10-11 | — | — | CN | claimed |
| CN-106470975-A | Synthesis of Polycyclic Carbamoylpyridone Compounds | 吉利德科学公司 | 2017-03-01 | — | — | CN | claimed |