⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21929526 | 0.80 | — | — | |
| SCHEMBL16077445 | 0.77 | — | — | |
| SCHEMBL1473425 | 0.73 | — | — | |
| SCHEMBL21542542 | 0.72 | — | — | |
| SCHEMBL13286236 | 0.72 | — | — | |
| SCHEMBL2544000 | 0.71 | — | — | |
| SCHEMBL28034222 | 0.71 | — | — | |
| SCHEMBL6129980 | 0.69 | ALDH1A1 (0.33) | — | |
| SCHEMBL6130000 | 0.69 | TSHR (0.33) | — | |
| SCHEMBL18113286 | 0.69 | ALOX15 (0.46) | — |
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-2023126297-A1 | ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES | BYONDIS B.V. (NL) | 2023-07-06 | — | — | WO | disclosed |