⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4618869 | 0.96 | — | — | |
| SCHEMBL349094 | 0.78 | LMNA (0.39) | — | |
| SCHEMBL6728521 | 0.76 | — | — | |
| SCHEMBL6361837 | 0.76 | — | — | |
| SCHEMBL27480254 | 0.71 | — | — | |
| SCHEMBL27991569 | 0.71 | — | — | |
| SCHEMBL27991561 | 0.69 | — | — | |
| SCHEMBL3892557 | 0.67 | — | — | |
| SCHEMBL3893707 | 0.67 | — | — | |
| SCHEMBL5429936 | 0.67 | — | — |
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-110167949-B | Iron oxynitrides complexes, catalytic systems comprising them and processes for the (co) polymerization of conjugated dienes | 维尔萨利斯股份公司 | 2022-08-23 | — | — | CN | disclosed |