⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28343886 | 0.93 | — | — | |
| SCHEMBL104286 | 0.78 | — | — | |
| SCHEMBL8445564 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL15733100 | 0.72 | BRD4 (0.46) | — | |
| SCHEMBL28250858 | 0.71 | TSHR (0.37) | — | |
| SCHEMBL7083821 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL103451 | 0.70 | — | — | |
| SCHEMBL14267986 | 0.68 | — | — | |
| SCHEMBL6428694 | 0.68 | — | — | |
| SCHEMBL1809098 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3190111-B1 | PYRAZOLO[3,4-C]PYRIDINE DERIVATIVES | CSPC ZHONGQI PHARMACEUTICAL TECH SHIJIAZHUANG CO LTD (CN) | 2020-05-06 | — | — | EP | disclosed |
| EP-3190111-A1 | PYRAZOLO[3,4-C]PYRIDINE DERIVATIVES | CSPC Zhongqi Pharmaceutical Technology (Shijiazhuang) Co., Ltd. (CN) | 2017-07-12 | — | — | EP | disclosed |