⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14302074 | 0.76 | — | — | |
| SCHEMBL7107068 | 0.75 | — | — | |
| SCHEMBL732800 | 0.73 | — | — | |
| SCHEMBL732802 | 0.73 | — | — | |
| SCHEMBL1166566 | 0.73 | — | — | |
| SCHEMBL25472780 | 0.70 | — | — | |
| SCHEMBL731253 | 0.70 | — | — | |
| SCHEMBL12336191 | 0.67 | — | — | |
| SCHEMBL25675039 | 0.67 | — | — | |
| SCHEMBL1101946 | 0.64 | — | — |
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-2374812-A2 | 4-amino-4-oxobutanoyl Peptides as Inhibitors of Viral Replication | Achillion Pharmaceuticals, Inc. (US) | 2011-10-12 | — | — | EP | disclosed |