⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7323390 | 0.92 | REN (0.32) | — | |
| SCHEMBL7316972 | 0.91 | REN (0.30) | — | |
| SCHEMBL7326352 | 0.90 | REN (0.31) | — | |
| SCHEMBL7320027 | 0.87 | CTSS (0.34) | — | |
| SCHEMBL7320023 | 0.84 | CTSS (0.32) | — | |
| SCHEMBL7309951 | 0.81 | REN (0.35) | — | |
| SCHEMBL7323447 | 0.81 | REN (0.39) | — | |
| SCHEMBL7309957 | 0.80 | CTSB (0.34) | — | |
| SCHEMBL7319388 | 0.78 | REN (0.39) | — | |
| SCHEMBL7319383 | 0.77 | REN (0.35) | — |
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-0231919-B1 | N-HETEROCYCLIC ALCOHOL RENIN INHIBITORS | E.R. Squibb & Sons, Inc. (US) | 1993-01-20 | — | — | EP | disclosed |