⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7417526 | 1.00 | — | — | |
| SCHEMBL24498852 | 0.85 | — | — | |
| SCHEMBL24498691 | 0.85 | — | — | |
| SCHEMBL24498692 | 0.85 | — | — | |
| SCHEMBL23777974 | 0.81 | SLC1A2 (0.46) | — | |
| SCHEMBL3232157 | 0.80 | DPP7 (0.55) | — | |
| Norleucine SCHEMBL26474 | 0.78 | SLC1A2 (0.67) | — | |
| Norleucine SCHEMBL2785913 | 0.78 | SLC1A2 (0.67) | — | |
| SCHEMBL1798408 | 0.78 | — | — | |
| SCHEMBL1290172 | 0.78 | — | — |
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-109030815-B | Protein chip for detecting liquid phase protein interaction and preparation method and application thereof | 安徽医科大学 | 2021-08-10 | — | — | CN | disclosed |