⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23868181 | 0.82 | EPHX1 (0.33) | — | |
| SCHEMBL4610021 | 0.82 | EPHX1 (0.46) | — | |
| SCHEMBL3462913 | 0.78 | EPHX1 (0.34) | — | |
| SCHEMBL16079856 | 0.76 | — | — | |
| SCHEMBL2623186 | 0.75 | EPHX1 (0.39) | — | |
| SCHEMBL91653 | 0.74 | — | — | |
| SCHEMBL17000501 | 0.73 | — | — | |
| SCHEMBL2623189 | 0.73 | EPHX1 (0.38) | — | |
| SCHEMBL13130049 | 0.73 | EPHX1 (0.52) | — | |
| SCHEMBL13923483 | 0.72 | PTGS1 (0.32) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170313745-A1 | INHIBITORS OF HEPATITIS C VIRUS | GILEAD SCIENCES, INC. | 2017-11-02 | — | — | US | disclosed |
| US-9617310-B2 | Inhibitors of hepatitis C virus | GILEAD SCIENCES, INC. (US) | 2017-04-11 | — | — | US | disclosed |
| US-20140274884-A1 | INHIBITORS OF HEPATITIS C VIRUS | GILEAD SCIENCES, INC. | 2014-09-18 | — | — | US | disclosed |
| US-20120242941-A1 | LIQUID CRYSTAL DISPLAY DEVICE AND METHOD FOR MANUFACTURING THE SAME | SONY CORPORATION (JP) | 2012-09-27 | — | — | US | disclosed |