⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2142076 | 0.78 | — | — | |
| SCHEMBL652609 | 0.69 | — | — | |
| SCHEMBL652608 | 0.69 | — | — | |
| SCHEMBL2270728 | 0.69 | — | — | |
| SCHEMBL8078696 | 0.69 | — | — | |
| SCHEMBL5433784 | 0.67 | — | — | |
| SCHEMBL1273918 | 0.67 | — | — | |
| SCHEMBL20846185 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL22771832 | 0.67 | — | — | |
| SCHEMBL516459 | 0.67 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1177178-B1 | HETEROCYCLICALLY SUBSTITUTED BENZIMIDAZOLES, THE PRODUCTION AND APPLICATION THEREOF | ABBOTT GMBH & CO KG (DE) | 2004-12-29 | — | — | EP | disclosed |