⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL222523 | 0.75 | — | — | |
| Bromide SCHEMBL10546295 | 0.73 | — | — | |
| SCHEMBL28091522 | 0.73 | CA2 (0.33) | — | |
| SCHEMBL9161788 | 0.73 | — | — | |
| SCHEMBL23057360 | 0.72 | CA2 (0.44) | — | |
| SCHEMBL17469699 | 0.72 | CA2 (0.44) | — | |
| SCHEMBL6509468 | 0.71 | — | — | |
| SCHEMBL30827180 | 0.71 | CA2 (0.36) | — | |
| SCHEMBL8621251 | 0.71 | — | — | |
| SCHEMBL966326 | 0.69 | — | — |
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-108348504-B | Compound with HCV (hepatitis C Virus) inhibiting activity as well as preparation method and application thereof | 江苏豪森药业集团有限公司 | 2021-06-29 | — | — | CN | disclosed |