⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11554337 | 0.68 | — | — | |
| SCHEMBL8951795 | 0.63 | — | — | |
| SCHEMBL10615863 | 0.63 | — | — | |
| SCHEMBL6474388 | 0.50 | — | — | |
| Ethane SCHEMBL28145011 | 0.50 | — | — | |
| SCHEMBL7102867 | 0.50 | — | — | |
| SCHEMBL6305499 | 0.50 | — | — | |
| SCHEMBL23382219 | 0.47 | — | — | |
| SCHEMBL1263429 | 0.47 | — | — | |
| SCHEMBL18131679 | 0.47 | — | — |
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-0736533-A1 | Intermediates and process for the preparation of an antiviral agent | BRISTOL-MYERS SQUIBB COMPANY (US) | 1996-10-09 | — | — | EP | disclosed |