⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24538983 | 0.75 | — | — | |
| SCHEMBL17971811 | 0.72 | — | — | |
| SCHEMBL784042 | 0.72 | GSK3A (0.33) | — | |
| SCHEMBL15468843 | 0.62 | TOP2A (0.30) | — | |
| SCHEMBL18069611 | 0.60 | — | — | |
| SCHEMBL15032496 | 0.57 | — | — | |
| SCHEMBL784155 | 0.56 | DHFR (0.35) | — | |
| SCHEMBL16639881 | 0.55 | — | — | |
| SCHEMBL18774502 | 0.55 | — | — | |
| SCHEMBL12411019 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230357168-A1 | CARBOBICYCLIC NUCLEOSIDES FOR TREATMENT OF VIRAL INFECTION | UNIV HONG KONG CHINESE (CN) | 2023-11-09 | — | — | US | disclosed |