⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29904237 | 1.00 | — | — | |
| SCHEMBL26598783 | 1.00 | — | — | |
| SCHEMBL9931703 | 0.81 | — | — | |
| SCHEMBL28735939 | 0.77 | — | — | |
| SCHEMBL27139016 | 0.77 | IDO1 (0.35) | — | |
| SCHEMBL29693758 | 0.75 | — | — | |
| SCHEMBL21330629 | 0.75 | — | — | |
| SCHEMBL29801557 | 0.75 | — | — | |
| SCHEMBL31564702 | 0.75 | — | — | |
| SCHEMBL191637 | 0.75 | — | — |
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-2022212818-A1 | 1,2,4-TRIAZOLO[4,3-A]PYRIDINE DERIVATIVES AS NEGATIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR 2 | VANDERBILT UNIVERSITY (US) | 2022-10-06 | — | — | WO | disclosed |