⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1128 | 0.90 | AGTR1 (0.54) | — | |
| SCHEMBL674 | 0.89 | — | — | |
| SCHEMBL6534661 | 0.82 | AGTR1 (0.66) | — | |
| SCHEMBL753 | 0.82 | AGTR1 (0.65) | — | |
| SCHEMBL775 | 0.82 | AGTR1 (0.55) | — | |
| SCHEMBL394 | 0.81 | AGTR1 (0.61) | — | |
| Hydrochloric Acid SCHEMBL716 | 0.81 | AGTR1 (0.54) | — | |
| SCHEMBL687 | 0.81 | AGTR1 (0.54) | — | |
| SCHEMBL396 | 0.81 | AGTR1 (0.62) | — | |
| SCHEMBL643 | 0.79 | AGTR1 (0.54) | — |
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-0253310-A2 | Angiotensin II receptor blocking imidazoles | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1988-01-20 | — | — | EP | disclosed |