⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28471816 | 0.85 | KDM4E (0.31) | — | |
| SCHEMBL28471390 | 0.72 | PKM (0.37) | — | |
| SCHEMBL16209792 | 0.71 | KDM4E (0.33) | — | |
| SCHEMBL28475017 | 0.70 | PDK2 (0.32) | — | |
| SCHEMBL28469099 | 0.69 | KDM4E (0.32) | — | |
| SCHEMBL28901156 | 0.69 | L3MBTL3 (0.36) | — | |
| Hydrochloric Acid SCHEMBL28480488 | 0.68 | L3MBTL3 (0.36) | — | |
| SCHEMBL5901471 | 0.67 | SPR (0.33) | — | |
| SCHEMBL28480518 | 0.66 | SMN1; SMN2 (0.39) | — | |
| SCHEMBL4365735 | 0.64 | MMP1 (0.35) | — |
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-111808135-A | Functionally modified oligonucleotides and subunits thereof | 萨勒普塔医疗公司 | 2020-10-23 | — | — | CN | disclosed |