⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5789431 | 0.78 | — | — | |
| SCHEMBL6352348 | 0.76 | — | — | |
| SCHEMBL10696629 | 0.67 | — | — | |
| SCHEMBL17479482 | 0.67 | — | — | |
| SCHEMBL28717718 | 0.66 | — | — | |
| SCHEMBL2301033 | 0.64 | — | — | |
| SCHEMBL5857957 | 0.63 | — | — | |
| SCHEMBL28128554 | 0.63 | — | — | |
| SCHEMBL2727812 | 0.63 | — | — | |
| SCHEMBL231052 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008084067-A2 | PHARMACEUTICALLY ACTIVE DIHYDROBENZOFURANE-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES | NYCOMED GMBH (DE) | 2008-07-17 | — | — | WO | disclosed |