⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3789319 | 0.69 | — | — | |
| SCHEMBL1092782 | 0.69 | — | — | |
| SCHEMBL7356116 | 0.69 | — | — | |
| SCHEMBL28213659 | 0.69 | — | — | |
| SCHEMBL23912112 | 0.68 | — | — | |
| SCHEMBL361101 | 0.67 | — | — | |
| SCHEMBL7977824 | 0.67 | — | — | |
| SCHEMBL19241033 | 0.67 | — | — | |
| SCHEMBL7405294 | 0.67 | — | — | |
| SCHEMBL6014458 | 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-0113998-A2 | Composition and treatment for herpes simplex viral infections | HERPES PHARMACEUTICAL, INC. (US) | 1984-07-25 | — | — | EP | disclosed |