⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12066432 | 0.74 | — | — | |
| SCHEMBL6629045 | 0.74 | — | — | |
| SCHEMBL4982998 | 0.73 | — | — | |
| SCHEMBL14431373 | 0.73 | — | — | |
| SCHEMBL15925109 | 0.70 | HTR2A (0.31) | — | |
| SCHEMBL12910052 | 0.70 | CHRM4 (0.34) | — | |
| SCHEMBL16508872 | 0.70 | ACHE (0.35) | — | |
| SCHEMBL12130159 | 0.68 | PARP2 (0.33) | — | |
| SCHEMBL13927891 | 0.68 | ACHE (0.34) | — | |
| SCHEMBL15731211 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230248834-A1 | DEGRADATION OF (EGFR) BY CONJUGATION OF EGFR INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE | BEONE MEDICINES I GMBH (CH) | 2023-08-10 | — | — | US | disclosed |