⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23220203 | 0.84 | — | — | |
| SCHEMBL18824011 | 0.76 | SIRT6 (0.30) | — | |
| SCHEMBL18594710 | 0.72 | CA2 (0.31) | — | |
| SCHEMBL19483440 | 0.71 | CPB2 (0.38) | — | |
| SCHEMBL20992224 | 0.68 | — | — | |
| SCHEMBL23805338 | 0.66 | — | — | |
| SCHEMBL23801160 | 0.65 | — | — | |
| SCHEMBL24943948 | 0.65 | GSR (0.47) | — | |
| SCHEMBL19647402 | 0.65 | CPB2 (0.33) | — | |
| SCHEMBL18823998 | 0.64 | — | — |
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-20200164084-A1 | ANTIBODY CONJUGATES COMPRISING TOLL-LIKE RECEPTOR AGONIST AND COMBINATION THERAPIES | NOVARTIS AG (CH) | 2020-05-28 | — | — | US | disclosed |