⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1979240 | 0.75 | — | — | |
| SCHEMBL424369 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL4661161 | 0.73 | — | — | |
| SCHEMBL19999997 | 0.68 | RAB9A (0.36) | — | |
| SCHEMBL1239176 | 0.68 | — | — | |
| SCHEMBL19673764 | 0.68 | — | — | |
| SCHEMBL1011490 | 0.67 | — | — | |
| SCHEMBL19673842 | 0.64 | — | — | |
| SCHEMBL3616173 | 0.64 | MEN1 (0.34) | — | |
| SCHEMBL3995153 | 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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8124584-B2 | Macrocyclic hepatitis C serine protease inhibitors | ENANTA PHARMACEUTICALS, INC. (US) | 2012-02-28 | — | — | US | claimed |
| US-20090304629-A1 | MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS | MIAO ZHENWEI | 2009-12-10 | — | — | US | claimed |
| US-7601709-B2 | Macrocyclic hepatitis C serine protease inhibitors | ENANTA PHARMACEUTICALS, INC. (US) | 2009-10-13 | — | — | US | claimed |
| US-5342937-A | Extraction of metals especially gallium | ZENECA, LIMITED (GB) | 1994-08-30 | — | — | US | claimed |
| EP-0408203-A2 | Heterocyclic thione | ZENECA LIMITED (GB) | 1991-01-16 | — | — | EP | claimed |
| US-5342937-A | Extraction of metals especially gallium | ZENECA, LIMITED (GB) | 1994-08-30 | — | — | US | disclosed |
| US-5074911-A | Extracting metal values from aqueous solution with immiscible solvent and dissolved heterocyclic thione | IMPERICAL CHEMICAL INDUSTRIES PLC (GB) | 1991-12-24 | — | — | US | disclosed |
| EP-0408203-A2 | Heterocyclic thione | ZENECA LIMITED (GB) | 1991-01-16 | — | — | EP | disclosed |