⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15996249 | 0.95 | — | — | |
| SCHEMBL20055059 | 0.76 | — | — | |
| SCHEMBL2048749 | 0.74 | — | — | |
| SCHEMBL2705984 | 0.74 | — | — | |
| SCHEMBL6475879 | 0.74 | — | — | |
| SCHEMBL796532 | 0.73 | — | — | |
| SCHEMBL14268215 | 0.70 | PIK3CD (0.34) | — | |
| SCHEMBL13070424 | 0.68 | CYP2D6 (0.32) | — | |
| SCHEMBL2705941 | 0.68 | — | — | |
| SCHEMBL11686159 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3309157-A1 | ANTIVIRAL COMPOUNDS | Gilead Pharmasset LLC (US) | 2018-04-18 | — | — | EP | disclosed |