⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11206177 | 0.74 | — | — | |
| SCHEMBL25667496 | 0.73 | — | — | |
| SCHEMBL24839167 | 0.67 | — | — | |
| SCHEMBL73470 | 0.67 | — | — | |
| SCHEMBL11764732 | 0.66 | — | — | |
| SCHEMBL25666985 | 0.65 | — | — | |
| SCHEMBL20976357 | 0.65 | — | — | |
| SCHEMBL22986927 | 0.64 | SPHK2 (0.41) | — | |
| SCHEMBL18599927 | 0.62 | CA12 (0.31) | — | |
| SCHEMBL73471 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4289503-A1 | SORBENT MATERIALS FOR CARBON DIOXIDE SEPARATION | ZHAW - Zürcher Hochschule für Angewandte Wissenschaften (CH) | 2023-12-13 | — | — | EP | disclosed |