⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL441447 | 0.83 | — | — | |
| SCHEMBL4008535 | 0.79 | — | — | |
| SCHEMBL8862970 | 0.79 | — | — | |
| SCHEMBL27056303 | 0.79 | — | — | |
| SCHEMBL396350 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL4609656 | 0.78 | HRH4 (0.43) | — | |
| Bromide SCHEMBL1397996 | 0.78 | HRH4 (0.40) | — | |
| SCHEMBL13178620 | 0.78 | — | — | |
| SCHEMBL13178613 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL630213 | 0.78 | HRH4 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5541229-A | ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS | DR. KARL THOMAE GMBH (DE) | 1996-07-30 | — | — | US | disclosed |