⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25668342 | 0.86 | — | — | |
| SCHEMBL20828877 | 0.82 | SOAT1 (0.39) | — | |
| SCHEMBL17875036 | 0.77 | SOAT1 (0.43) | — | |
| SCHEMBL9713024 | 0.76 | CES1 (0.46) | — | |
| SCHEMBL466897 | 0.76 | — | — | |
| SCHEMBL17715350 | 0.75 | TDP1 (0.41) | — | |
| SCHEMBL10918526 | 0.75 | — | — | |
| SCHEMBL44321 | 0.75 | — | — | |
| SCHEMBL1412588 | 0.75 | — | — | |
| SCHEMBL466776 | 0.74 | — | — |
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-2021104120-A1 | POLYETHYLENE GLYCOL CONJUGATE MEDICAMENT, PREPARATION METHOD THERFOR AND USE THEREOF | 重庆阿普格雷生物科技有限公司 | 2021-06-03 | — | — | WO | disclosed |