⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10223436 | 0.76 | TP53 (0.37) | — | |
| SCHEMBL112567 | 0.69 | TSHR (0.36) | — | |
| SCHEMBL13472106 | 0.67 | — | — | |
| SCHEMBL4625077 | 0.67 | — | — | |
| SCHEMBL13552278 | 0.67 | KDM4E (0.31) | — | |
| SCHEMBL12788412 | 0.67 | — | — | |
| SCHEMBL4959965 | 0.67 | — | — | |
| Fluoride SCHEMBL22032650 | 0.66 | TSHR (0.33) | — | |
| Hydrochloric Acid SCHEMBL4316309 | 0.66 | TSHR (0.33) | — | |
| Hydrochloric Acid SCHEMBL4662388 | 0.66 | TSHR (0.33) | — |
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-11787831-B2 | Nucleosides and nucleotides with 3′ acetal blocking group | ILLUMINA CAMBRIDGE LIMITED (GB) | 2023-10-17 | — | — | US | disclosed |