⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24739737 | 0.81 | — | — | |
| SCHEMBL24739736 | 0.78 | — | — | |
| SCHEMBL31292285 | 0.70 | DGAT1 (0.38) | — | |
| SCHEMBL31292441 | 0.69 | CYP2C19 (0.39) | — | |
| SCHEMBL38654883 | 0.69 | SIRT6 (0.33) | — | |
| SCHEMBL18648250 | 0.67 | HMGCR (0.32) | — | |
| SCHEMBL24739741 | 0.66 | CNR1 (0.34) | — | |
| SCHEMBL19934860 | 0.66 | NPC1 (0.38) | — | |
| SCHEMBL23517888 | 0.64 | LMNA (0.37) | — | |
| SCHEMBL21016489 | 0.64 | — | — |
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-2022253283-A1 | PROTEIN KINASE DEGRADANT AND USE THEREOF | 中国科学院上海有机化学研究所 | 2022-12-08 | — | — | WO | disclosed |