⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26322001 | 0.83 | — | — | |
| SCHEMBL24628793 | 0.80 | — | — | |
| SCHEMBL27266026 | 0.76 | — | — | |
| SCHEMBL22225670 | 0.73 | — | — | |
| SCHEMBL20793406 | 0.70 | — | — | |
| SCHEMBL27429911 | 0.69 | — | — | |
| SCHEMBL27375348 | 0.67 | — | — | |
| SCHEMBL24167902 | 0.64 | — | — | |
| SCHEMBL16411374 | 0.64 | MEN1 (0.36) | — | |
| SCHEMBL22907862 | 0.63 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021128519-A1 | COMBINATION OF DNA METHYLATION BIOMARKERS, AND DETECTION METHOD THEREFOR AND KIT THEREOF | 广州市基准医疗有限责任公司 | 2021-07-01 | — | — | WO | disclosed |