⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7487796 | 0.64 | MPO (0.36) | — | |
| SCHEMBL18986300 | 0.61 | — | — | |
| SCHEMBL31018444 | 0.60 | — | — | |
| Hydrochloric Acid SCHEMBL27681770 | 0.56 | — | — | |
| SCHEMBL275382 | 0.56 | — | — | |
| SCHEMBL9851251 | 0.55 | ALDH1A1 (0.32) | — | |
| SCHEMBL184140 | 0.53 | MPO (0.33) | — | |
| SCHEMBL17982500 | 0.52 | — | — | |
| SCHEMBL22194953 | 0.52 | MPO (0.30) | — | |
| SCHEMBL7266578 | 0.52 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0184738-A2 | Imidazole derivatives, medicaments containing these compounds, and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1986-06-18 | — | — | EP | claimed |
| EP-0184738-A2 | Imidazole derivatives, medicaments containing these compounds, and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1986-06-18 | — | — | EP | disclosed |