⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5459692 | 0.87 | KDR (0.31) | — | |
| SCHEMBL5452232 | 0.85 | TEK (0.30) | — | |
| SCHEMBL5448421 | 0.85 | TEK (0.37) | — | |
| SCHEMBL5444133 | 0.82 | RIPK1 (0.38) | — | |
| SCHEMBL5450929 | 0.81 | — | — | |
| SCHEMBL5452397 | 0.77 | PIM1 (0.31) | — | |
| SCHEMBL5444068 | 0.76 | TEK (0.37) | — | |
| SCHEMBL5766188 | 0.75 | CBFB (0.33) | — | |
| SCHEMBL5449919 | 0.73 | KDR (0.36) | — | |
| SCHEMBL5458915 | 0.73 | KDR (0.35) | — |
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-20070021456-A1 | Aminobenzimidazole derivatives | MERCK PATENT GMBH (DE) | 2007-01-25 | — | — | US | claimed |
| EP-1656377-A1 | AMINOBENZIMIDAZOLE DERIVATIVES | MERCK PATENT GmbH (DE) | 2006-05-17 | — | — | EP | claimed |
| WO-2005019216-A1 | AMINOBENZIMIDAZOLE DERIVATIVES | MERCK PATENT GMBH (DE) | 2005-03-03 | — | — | WO | claimed |