⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21782166 | 0.77 | — | — | |
| SCHEMBL18688142 | 0.73 | — | — | |
| SCHEMBL17303073 | 0.64 | — | — | |
| SCHEMBL17993964 | 0.62 | — | — | |
| SCHEMBL916373 | 0.60 | — | — | |
| SCHEMBL806479 | 0.59 | — | — | |
| SCHEMBL917042 | 0.56 | — | — | |
| SCHEMBL12159646 | 0.56 | — | — | |
| SCHEMBL16359589 | 0.56 | — | — | |
| SCHEMBL12319503 | 0.56 | KDM4E (0.33) | — |
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-11560422-B2 | Sulfonamide-containing linkage systems for drug conjugates | ZYMEWORKS INC. | 2023-01-24 | — | — | US | disclosed |