⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17402978 | 0.86 | — | — | |
| SCHEMBL17402977 | 0.86 | — | — | |
| SCHEMBL20108517 | 0.86 | — | — | |
| SCHEMBL20108483 | 0.82 | — | — | |
| SCHEMBL20108510 | 0.82 | — | — | |
| SCHEMBL17402976 | 0.81 | — | — | |
| SCHEMBL20108516 | 0.79 | — | — | |
| SCHEMBL17402981 | 0.77 | — | — | |
| SCHEMBL16014825 | 0.74 | — | — | |
| SCHEMBL20108362 | 0.74 | — | — |
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-2964635-B1 | ANTIVIRAL COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2018-05-02 | — | — | EP | disclosed |