⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12477657 | 1.00 | — | — | |
| SCHEMBL1287248 | 0.89 | — | — | |
| SCHEMBL7772973 | 0.89 | — | — | |
| SCHEMBL21052575 | 0.83 | MMP1 (0.31) | — | |
| SCHEMBL17818353 | 0.83 | MMP1 (0.31) | — | |
| SCHEMBL12477586 | 0.81 | — | — | |
| SCHEMBL12477192 | 0.78 | ALDH1A1 (0.34) | — | |
| SCHEMBL29440237 | 0.78 | — | — | |
| SCHEMBL29440235 | 0.78 | — | — | |
| SCHEMBL28468544 | 0.78 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111909231-A | 2 ' and/or 5 ' -amino acid ester phosphoramidate 3 ' -deoxyadenosine derivatives as anticancer compounds | 努卡那有限公司 | 2020-11-10 | — | — | CN | disclosed |
| CN-107207554-B | 2 ' and/or 5 ' -amino acid ester phosphoramidate 3 ' -deoxyadenosine derivatives as anticancer compounds | 努卡那有限公司 | 2020-09-11 | — | — | CN | disclosed |
| CN-111527098-A | Phosphoramidate diphosphate salt of nucleoside as anticancer compound | 努卡那公共有限公司 | 2020-08-11 | — | — | CN | disclosed |