⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4574691 | 0.74 | — | — | |
| SCHEMBL2045505 | 0.71 | — | — | |
| SCHEMBL2236284 | 0.71 | — | — | |
| SCHEMBL29440891 | 0.69 | — | — | |
| SCHEMBL24154842 | 0.69 | — | — | |
| Potassium Ion SCHEMBL2765217 | 0.67 | — | — | |
| SCHEMBL3677609 | 0.67 | — | — | |
| SCHEMBL29085407 | 0.65 | HTT (0.33) | — | |
| SCHEMBL4459976 | 0.65 | — | — | |
| SCHEMBL10610812 | 0.65 | — | — |
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-3250581-B1 | ALPHA-D-GALACTOSIDE INHIBITORS OF GALECTINS | GALECTO BIOTECH AB (DK) | 2021-01-20 | — | — | EP | disclosed |