⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1888312 | 0.64 | — | — | |
| SCHEMBL11578490 | 0.59 | TDP1 (0.33) | — | |
| SCHEMBL2348190 | 0.56 | — | — | |
| SCHEMBL6448149 | 0.56 | — | — | |
| SCHEMBL11580702 | 0.56 | KDM4E (0.31) | — | |
| SCHEMBL9015336 | 0.54 | — | — | |
| SCHEMBL7754752 | 0.53 | ACHE (0.33) | — | |
| SCHEMBL11105828 | 0.50 | — | — | |
| SCHEMBL10455200 | 0.50 | TDP1 (0.37) | — | |
| SCHEMBL7886293 | 0.49 | ALOX5 (0.37) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20060116390-A1 | Hepatitis c virus inhibitors | LG LIFE SCIENCES LTD. (KR) | 2006-06-01 | — | — | US | disclosed |
| EP-1633725-A1 | HEPATITIS C VIRUS INHIBITORS | LG Life Sciences Ltd. (KR) | 2006-03-15 | — | — | EP | disclosed |
| WO-2004111013-A1 | HEPATITIS C VIRUS INHIBITORS | LG LIFE SCIENCES LTD. (KR) | 2004-12-23 | — | — | WO | disclosed |