⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6079698 | 0.83 | — | — | |
| SCHEMBL6837539 | 0.79 | — | — | |
| SCHEMBL11026302 | 0.70 | — | — | |
| SCHEMBL199218 | 0.70 | ACE2 (0.48) | — | |
| SCHEMBL200820 | 0.70 | LMNA (0.43) | — | |
| SCHEMBL25185980 | 0.68 | ACE2 (0.47) | — | |
| SCHEMBL25185981 | 0.68 | ACE2 (0.52) | — | |
| SCHEMBL8843869 | 0.68 | ACE2 (0.52) | — | |
| SCHEMBL25181811 | 0.68 | ACE2 (0.52) | — | |
| SCHEMBL21219900 | 0.68 | ACE2 (0.52) | — |
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-0361341-A2 | Therapeutics for aids based on inhibitors of HIV protease | MILES INC. (US) | 1990-04-04 | — | — | EP | claimed |