⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8969830 | 0.88 | — | — | |
| SCHEMBL7608268 | 0.87 | — | — | |
| SCHEMBL8971013 | 0.84 | AGTR2 (0.66) | — | |
| SCHEMBL7608200 | 0.81 | AGTR1 (0.63) | — | |
| SCHEMBL3625358 | 0.77 | AGTR2 (0.61) | — | |
| SCHEMBL8640736 | 0.76 | AGTR2 (0.56) | — | |
| SCHEMBL7612129 | 0.76 | AGTR1 (0.57) | — | |
| SCHEMBL7613378 | 0.76 | AGTR1 (0.60) | — | |
| SCHEMBL9483479 | 0.75 | AGTR2 (0.76) | — | |
| SCHEMBL7617595 | 0.75 | AGTR1 (0.76) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6486189-B2 | TREATMENT OR PROPHYLAXIS OF AN ILLNESS CAUSED BY AN ISCHEMIC CONDITION, OR FOR THE TREATMENT OF IMPAIRED RESPIRATORY DRIVE | HOECHST AKTIENGESELLSCHAFT (DE) | 2002-11-26 | — | — | US | disclosed |
| US-20020045761-A1 | Five-membered heterocycles having biphenylsulfonyl substitution, process for their preparation, their use as a medicament or diagnostic, and medicament comprising them | KLEEMANN HEINZ-WERNER (DE) | 2002-04-18 | — | — | US | disclosed |
| US-6335451-B1 | ANTIARRYTHMIA AGENTS, ANTIPROLIFERATIVE AGENTS | HOECHST AKTIENGESELLSCHAFT (DE) | 2002-01-01 | — | — | US | disclosed |