⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19833415 | 0.97 | — | — | |
| SCHEMBL19833401 | 0.93 | — | — | |
| SCHEMBL19833402 | 0.91 | — | — | |
| SCHEMBL19833390 | 0.91 | — | — | |
| SCHEMBL19833619 | 0.91 | — | — | |
| SCHEMBL19833525 | 0.91 | — | — | |
| SCHEMBL19833374 | 0.90 | — | — | |
| SCHEMBL19821790 | 0.90 | — | — | |
| SCHEMBL19833511 | 0.89 | — | — | |
| SCHEMBL19833400 | 0.89 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180030016-A1 | BENZOFURAN COMPOUNDS FOR THE TREATMENT OF HEPATITIS C | BRISTOL MYERS SQUIBB CO (US) | 2018-02-01 | — | — | US | disclosed |