⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL8037367 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL8033568 | 0.70 | — | — | |
| SCHEMBL14580320 | 0.70 | — | — | |
| SCHEMBL11783445 | 0.70 | — | — | |
| SCHEMBL152843 | 0.67 | — | — | |
| SCHEMBL18335409 | 0.67 | — | — | |
| SCHEMBL14103800 | 0.67 | — | — | |
| SCHEMBL19688781 | 0.67 | — | — | |
| SCHEMBL23919427 | 0.65 | — | — | |
| SCHEMBL21566235 | 0.65 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017049316-A1 | ASSOCIATIVE POLYMERS TO CONTROL FORMATION OF PARTICULATE MATTER FROM IGNITABLE COMPOSITIONS AND RELATED COMPOSITIONS, METHODS AND SYSTEMS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2017-03-23 | — | — | WO | disclosed |
| EP-1730142-B1 | NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS | SCHERING CORP (US) | 2011-06-29 | — | — | EP | disclosed |
| EP-1737881-B1 | NOVEL COMPOUNDS AS INHIBITORS OF HEPATITIS C VIRUS NS3 SERINE PROTEASE | SCHERING CORP (US) | 2009-06-24 | — | — | EP | disclosed |
| EP-1343807-B1 | DIARYL PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITS C VIRUS | SCHERING CORP (US) | 2009-04-29 | — | — | EP | disclosed |
| EP-1939213-A1 | Novel compounds as inhibitors of hepatitis C virus NS3 serine protease | SCHERING CORPORATION (US) | 2008-07-02 | — | — | EP | disclosed |