⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9211338 | 1.00 | — | — | |
| SCHEMBL9206267 | 0.93 | — | — | |
| SCHEMBL9206268 | 0.93 | — | — | |
| SCHEMBL9209633 | 0.92 | AGTR1 (0.56) | — | |
| SCHEMBL9209632 | 0.92 | AGTR1 (0.56) | — | |
| SCHEMBL9214275 | 0.87 | — | — | |
| SCHEMBL9214266 | 0.87 | — | — | |
| SCHEMBL9208575 | 0.85 | AGTR1 (0.58) | — | |
| SCHEMBL7432919 | 0.85 | AGTR1 (0.60) | — | |
| SCHEMBL7432923 | 0.85 | AGTR1 (0.60) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0427463-B1 | Substituted N-(imidazolyl)alkyl alanine derivatives | SMITHKLINE BEECHAM CORP (US) | 1995-03-08 | — | — | EP | disclosed |
| US-5248689-A | Hypotensive agents, congestive heart failure, renal failure or glaucoma | SMITHKLINE BEECHAM CORPORATION (US) | 1993-09-28 | — | — | US | disclosed |
| EP-0427463-A1 | Substituted N-(imidazolyl)alkyl alanine derivatives | SMITHKLINE BEECHAM CORPORATION (US) | 1991-05-15 | — | — | EP | disclosed |