⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21344737 | 0.92 | — | — | |
| SCHEMBL21344688 | 0.92 | — | — | |
| SCHEMBL21285093 | 0.92 | MMP2 (0.32) | — | |
| SCHEMBL21344689 | 0.92 | — | — | |
| SCHEMBL21285231 | 0.90 | BTK (0.30) | — | |
| SCHEMBL22992079 | 0.89 | — | — | |
| SCHEMBL23344430 | 0.88 | — | — | |
| SCHEMBL21285145 | 0.88 | BTK (0.30) | — | |
| SCHEMBL21344686 | 0.88 | LMNA (0.31) | — | |
| SCHEMBL22992230 | 0.88 | LMNA (0.31) | — |
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-12043599-B2 | Herbicidal compounds | SYNGENTA PARTICIPATIONS AG (CH) | 2024-07-23 | — | — | US | disclosed |