⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22062514 | 0.88 | — | — | |
| SCHEMBL11226596 | 0.73 | — | — | |
| SCHEMBL24660161 | 0.73 | — | — | |
| SCHEMBL19760473 | 0.67 | KDM4E (0.30) | — | |
| SCHEMBL827966 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL2058230 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL1598785 | 0.65 | ALDH1A1 (0.39) | — | |
| SCHEMBL397849 | 0.65 | — | — | |
| SCHEMBL456719 | 0.62 | — | — | |
| SCHEMBL6356133 | 0.62 | ALDH1A1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180002368-A1 | NOVEL 3' END CAPS, 5' END CAPS AND COMBINATIONS THEREOF FOR THERAPEUTIC RNA | NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. | 2018-01-04 | — | — | US | disclosed |