⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15965926 | 0.82 | CD22 (0.31) | — | |
| SCHEMBL15966497 | 0.72 | L3MBTL1 (0.31) | — | |
| SCHEMBL22627107 | 0.64 | L3MBTL1 (0.42) | — | |
| SCHEMBL18463736 | 0.64 | L3MBTL1 (0.42) | — | |
| SCHEMBL15965915 | 0.62 | MANBA (0.33) | — | |
| SCHEMBL14823609 | 0.62 | MANBA (0.33) | — | |
| SCHEMBL15965921 | 0.59 | CD22 (0.31) | — | |
| SCHEMBL14823596 | 0.59 | CD22 (0.31) | — | |
| SCHEMBL14823602 | 0.59 | SIGLEC7 (0.32) | — | |
| SCHEMBL2017258 | 0.55 | — | — |
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-2013041732-A1 | TOTAL SYNTHESIS AND IMMUNOLOGICAL EVALUATION OF SACCHARIDE MOIETIES OF THE LIPOPOLYSACCHARIDE FROM NEISSERIA MENINGITIDIS | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2013-03-28 | — | — | WO | disclosed |