⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18757297 | 0.86 | FDPS (0.45) | — | |
| SCHEMBL3075816 | 0.79 | — | — | |
| SCHEMBL15770230 | 0.77 | CA2 (0.37) | — | |
| Pyrophosphoric Acid SCHEMBL28447258 | 0.76 | FDPS (0.77) | — | |
| SCHEMBL19026646 | 0.75 | FDPS (0.45) | — | |
| SCHEMBL13374689 | 0.75 | CA2 (0.35) | — | |
| SCHEMBL936042 | 0.73 | FDPS (0.60) | — | |
| SCHEMBL333911 | 0.73 | — | — | |
| SCHEMBL2045368 | 0.73 | — | — | |
| SCHEMBL338802 | 0.73 | FDPS (0.60) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9828408-B2 | HCV polymerase inhibitors | MEDIVIR AB (SE) | 2017-11-28 | — | — | US | disclosed |
| US-20170107244-A1 | HCV POLYMERASE INHIBITORS | MEDIVIR AB (SE) | 2017-04-20 | — | — | US | disclosed |