⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21366792 | 1.00 | — | — | |
| SCHEMBL12838001 | 0.78 | — | — | |
| SCHEMBL12769051 | 0.78 | — | — | |
| SCHEMBL24548501 | 0.78 | — | — | |
| SCHEMBL13177025 | 0.78 | — | — | |
| SCHEMBL18885184 | 0.74 | — | — | |
| SCHEMBL23875131 | 0.74 | — | — | |
| SCHEMBL21887760 | 0.74 | — | — | |
| SCHEMBL21550185 | 0.72 | — | — | |
| Leucine Amide SCHEMBL241528 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021236859-A1 | SYNTHESIS OF FLUORINATED NUCLEOTIDES | MERCK SHARP & DOHME CORP. (US) | 2021-11-25 | — | — | WO | disclosed |