⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL347823 | 0.78 | — | — | |
| SCHEMBL27399325 | 0.75 | — | — | |
| SCHEMBL8268594 | 0.75 | — | — | |
| SCHEMBL24279707 | 0.75 | — | — | |
| SCHEMBL14160006 | 0.75 | — | — | |
| SCHEMBL1938151 | 0.73 | — | — | |
| SCHEMBL7025326 | 0.73 | — | — | |
| SCHEMBL27432142 | 0.72 | PDK1 (0.30) | — | |
| SCHEMBL22993651 | 0.72 | THRB (0.30) | — | |
| SCHEMBL8637933 | 0.72 | — | — |
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-3361546-B1 | GEL POLYMER ELECTROLYTE AND LITHIUM SECONDARY BATTERY INCLUDING THE SAME | LG ENERGY SOLUTION LTD (KR) | 2023-06-07 | — | — | EP | disclosed |
| EP-3287441-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-02-28 | — | — | EP | disclosed |