⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30873318 | 0.87 | — | — | |
| SCHEMBL30873302 | 0.87 | — | — | |
| SCHEMBL19779082 | 0.86 | POLRMT (0.34) | — | |
| SCHEMBL20943594 | 0.85 | TMPRSS2 (0.33) | — | |
| SCHEMBL16698825 | 0.85 | TMPRSS2 (0.33) | — | |
| SCHEMBL19778893 | 0.83 | EGLN2 (0.33) | — | |
| SCHEMBL25386429 | 0.78 | POLRMT (0.36) | — | |
| SCHEMBL31430633 | 0.78 | POLRMT (0.33) | — | |
| SCHEMBL25391944 | 0.77 | POLRMT (0.37) | — | |
| SCHEMBL25387181 | 0.77 | POLRMT (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114085243-B | Pyrrolo [1,2-f ] [1,2,4] triazines useful for the treatment of respiratory syncytial virus infection | 吉利德科学公司 | 2024-04-26 | — | — | CN | disclosed |