⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22023540 | 0.75 | L3MBTL1 (0.31) | — | |
| SCHEMBL18463832 | 0.74 | L3MBTL1 (0.30) | — | |
| SCHEMBL16869870 | 0.71 | L3MBTL1 (0.50) | — | |
| SCHEMBL15910223 | 0.71 | L3MBTL1 (0.50) | — | |
| SCHEMBL18333556 | 0.71 | L3MBTL1 (0.50) | — | |
| SCHEMBL18463646 | 0.71 | L3MBTL1 (0.50) | — | |
| SCHEMBL15962573 | 0.71 | L3MBTL1 (0.50) | — | |
| SCHEMBL15250603 | 0.71 | L3MBTL1 (0.50) | — | |
| SCHEMBL22022488 | 0.71 | L3MBTL1 (0.50) | — | |
| SCHEMBL18934165 | 0.71 | L3MBTL1 (0.50) | — |
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-11161868-B2 | N-acetylated sialic acids and related sialosides | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2021-11-02 | — | — | US | disclosed |