⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9044929 | 0.93 | — | — | |
| SCHEMBL9041304 | 0.92 | — | — | |
| SCHEMBL9041950 | 0.92 | — | — | |
| SCHEMBL9042426 | 0.92 | — | — | |
| SCHEMBL9041839 | 0.91 | — | — | |
| SCHEMBL9040560 | 0.90 | AGTR1 (0.51) | — | |
| SCHEMBL9043323 | 0.89 | AGTR1 (0.54) | — | |
| SCHEMBL8394532 | 0.89 | — | — | |
| SCHEMBL9041265 | 0.88 | AGTR1 (0.52) | — | |
| SCHEMBL9039700 | 0.88 | AGTR1 (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-0392317-B1 | Benzimidazoles, drugs containing these compounds and process for their preparation | THOMAE GMBH DR K (DE) | 1996-01-03 | — | — | EP | disclosed |
| EP-0392317-A2 | Benzimidazoles, drugs containing these compounds and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1990-10-17 | — | — | EP | disclosed |