⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15326771 | 0.84 | — | — | |
| SCHEMBL7417410 | 0.71 | — | — | |
| SCHEMBL5838806 | 0.70 | — | — | |
| SCHEMBL18218365 | 0.69 | — | — | |
| SCHEMBL880119 | 0.66 | THRB (0.32) | — | |
| SCHEMBL7914176 | 0.65 | — | — | |
| SCHEMBL5271352 | 0.64 | — | — | |
| SCHEMBL8637 | 0.64 | THRB (0.30) | — | |
| SCHEMBL2735487 | 0.64 | THRB (0.30) | — | |
| SCHEMBL28625481 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1206449-A1 | LACTAM INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE | BRISTOL-MYERS SQUIBB COMPANY (US) | 2002-05-22 | — | — | EP | disclosed |
| WO-2001007407-A1 | LACTAM INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2001-02-01 | — | — | WO | disclosed |