⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17395092 | 0.76 | — | — | |
| SCHEMBL29743292 | 0.67 | — | — | |
| SCHEMBL2611107 | 0.62 | — | — | |
| SCHEMBL9321930 | 0.62 | — | — | |
| SCHEMBL6900802 | 0.59 | ELANE (0.33) | — | |
| SCHEMBL2185838 | 0.59 | — | — | |
| SCHEMBL15322352 | 0.58 | — | — | |
| SCHEMBL19768876 | 0.58 | — | — | |
| SCHEMBL11683893 | 0.58 | — | — | |
| SCHEMBL14000768 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116745286-A | Novel galectin inhibitors of galectins | 格莱克特生物技术公司 | 2023-09-12 | — | — | CN | disclosed |