⚠ 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 | |
|---|---|---|---|---|
| Benzimidazole SCHEMBL10931770 | 1.00 | SMN1; SMN2 (0.50) | — | |
| Benzimidazole SCHEMBL461969 | 1.00 | SMN1; SMN2 (0.50) | — | |
| Benzimidazole SCHEMBL29358377 | 1.00 | — | — | |
| Benzimidazole SCHEMBL6009 | 1.00 | — | — | |
| Benzimidazole SCHEMBL23673327 | 0.97 | SMN1; SMN2 (0.48) | — | |
| Benzimidazole SCHEMBL20531480 | 0.97 | SMN1; SMN2 (0.48) | — | |
| Benzimidazole SCHEMBL5131535 | 0.97 | — | — | |
| Benzimidazole SCHEMBL22551123 | 0.97 | SMN1; SMN2 (0.48) | — | |
| Benzimidazole SCHEMBL21046391 | 0.97 | — | — | |
| Benzimidazole SCHEMBL9589943 | 0.97 | SMN1; SMN2 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024243702-A1 | METAL NANOCLUSTERS AND METHODS OF USING SAME | QUEEN'S UNIVERSITY AT KINGSTON (CA) | 2024-12-05 | — | — | WO | disclosed |
| CN-111206260-B | Electrochemical synthesis method of pyrido [1,2-a ] benzimidazole compound | 齐鲁工业大学 | 2022-03-22 | — | — | CN | disclosed |