⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14958381 | 0.71 | — | — | |
| SCHEMBL6398827 | 0.71 | — | — | |
| SCHEMBL28599503 | 0.65 | — | — | |
| SCHEMBL6919608 | 0.63 | — | — | |
| SCHEMBL1539714 | 0.63 | — | — | |
| SCHEMBL21044876 | 0.63 | — | — | |
| SCHEMBL14953923 | 0.61 | — | — | |
| SCHEMBL14954288 | 0.61 | — | — | |
| SCHEMBL14953889 | 0.61 | — | — | |
| SCHEMBL1052803 | 0.61 | NOS3 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107847588-B | Molecular construct with targeting and effector moieties and uses thereof | 免疫功坊股份有限公司 | 2021-12-28 | — | — | CN | disclosed |
| CN-107106683-B | Molecular construct comprising targeting and effector components | 中央研究院 | 2021-07-20 | — | — | CN | disclosed |