⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL534331 | 0.82 | — | — | |
| SCHEMBL2441429 | 0.80 | PTPN5 (0.39) | — | |
| SCHEMBL791200 | 0.78 | — | — | |
| SCHEMBL29220546 | 0.78 | — | — | |
| SCHEMBL533521 | 0.75 | ALDH1A1 (0.38) | — | |
| SCHEMBL7173690 | 0.74 | HRH3 (0.31) | — | |
| SCHEMBL17154813 | 0.71 | LMNA (0.40) | — | |
| SCHEMBL30467058 | 0.71 | LMNA (0.40) | — | |
| SCHEMBL961068 | 0.71 | LMNA (0.40) | — | |
| SCHEMBL31201731 | 0.71 | LMNA (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117881661-A | Condensed heterocyclic derivative | 杨森科学爱尔兰无限公司 | 2024-04-12 | — | — | CN | disclosed |
| US-20070219210-A1 | Amidopyrazole Derivative | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2007-09-20 | — | — | US | disclosed |
| CN-1902191-A | Amidopyrazole derivative | DAIICHI SEIYAKU CO (JP) | 2007-01-24 | — | — | CN | disclosed |
| EP-1698626-A1 | AMIDOPYRAZOLE DERIVATIVE | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2006-09-06 | — | — | EP | disclosed |
| US-5364776-A | Biosynthesis, enzyme inhibitors, treatment of AIDS | MERCK & CO., INC. (US) | 1994-11-15 | — | — | US | disclosed |