⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17336861 | 0.89 | — | — | |
| SCHEMBL19196207 | 0.88 | — | — | |
| SCHEMBL19195892 | 0.87 | ADORA2A (0.46) | — | |
| SCHEMBL19196210 | 0.86 | — | — | |
| SCHEMBL19195887 | 0.86 | — | — | |
| SCHEMBL19196247 | 0.85 | — | — | |
| SCHEMBL19195886 | 0.85 | — | — | |
| SCHEMBL17348205 | 0.85 | — | — | |
| SCHEMBL19196249 | 0.84 | — | — | |
| SCHEMBL19196257 | 0.84 | SYK (0.48) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9969726-B2 | Metabotropic glutamate receptor negative allosteric modulators (NAMS) and uses thereof | SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) | 2018-05-15 | — | — | US | disclosed |
| US-20170217951-A1 | Metabotropic Glutamate Receptor Negative Allosteric Modulators (NAMS) and Uses Thereof | SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) | 2017-08-03 | — | — | US | disclosed |