⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8632766 | 0.89 | — | — | |
| SCHEMBL8635295 | 0.80 | AGTR1 (0.46) | — | |
| SCHEMBL8636053 | 0.80 | AGTR1 (0.45) | — | |
| SCHEMBL9010364 | 0.78 | MDM2 (0.35) | — | |
| SCHEMBL8636318 | 0.78 | AGTR1 (0.48) | — | |
| SCHEMBL9010398 | 0.77 | AGTR1 (0.45) | — | |
| SCHEMBL9010373 | 0.76 | AGTR1 (0.44) | — | |
| SCHEMBL7839692 | 0.74 | AGTR2 (0.50) | — | |
| SCHEMBL9010363 | 0.74 | — | — | |
| SCHEMBL7839345 | 0.74 | AGTR1 (0.57) | — |
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-5521206-A | HYPOTENSIVE AGENTS, TREATMENT OF ATHEROSCLEROSIS | BAYER AKTIENGESELLSCHAFT (DE) | 1996-05-28 | — | — | US | disclosed |