⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL568277 | 1.00 | — | — | |
| SCHEMBL7269068 | 1.00 | — | — | |
| Chlorobenzene SCHEMBL27547446 | 0.85 | CTSA (0.44) | — | |
| SCHEMBL7275386 | 0.84 | CYP1A2 (0.38) | — | |
| SCHEMBL17459345 | 0.83 | — | — | |
| SCHEMBL6608819 | 0.83 | — | — | |
| SCHEMBL7268614 | 0.82 | L3MBTL1 (0.39) | — | |
| SCHEMBL7268406 | 0.82 | L3MBTL1 (0.39) | — | |
| SCHEMBL7275150 | 0.82 | L3MBTL1 (0.39) | — | |
| SCHEMBL9095414 | 0.81 | L3MBTL1 (0.38) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0376012-A2 | Renin inhibitors | AMERICAN CYANAMID COMPANY (US) | 1990-07-04 | — | — | EP | disclosed |
| EP-0376040-A2 | N-phosphinyl di-and tripeptides as renin inhibitors | AMERICAN CYANAMID COMPANY (US) | 1990-07-04 | — | — | EP | disclosed |