⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30939853 | 0.90 | — | — | |
| SCHEMBL18636608 | 0.88 | CYP3A4 (0.32) | — | |
| SCHEMBL24148708 | 0.88 | CYP3A4 (0.32) | — | |
| SCHEMBL30939804 | 0.87 | TMPRSS2 (0.38) | — | |
| SCHEMBL31684173 | 0.87 | TMPRSS2 (0.38) | — | |
| SCHEMBL31684154 | 0.87 | TMPRSS2 (0.38) | — | |
| SCHEMBL31684122 | 0.83 | TMPRSS2 (0.30) | — | |
| SCHEMBL31684215 | 0.83 | TMPRSS2 (0.30) | — | |
| SCHEMBL31684147 | 0.83 | TMPRSS2 (0.30) | — | |
| SCHEMBL25012912 | 0.82 | CSNK1A1 (0.31) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024120464-A1 | NUCLEOTIDE ANALOG, AND COMPOSITION AND USE THEREOF | 深圳市塔吉瑞生物医药有限公司 | 2024-06-13 | — | — | WO | disclosed |