⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31424 | 0.65 | — | — | |
| SCHEMBL20211 | 0.62 | — | — | |
| Bromide SCHEMBL29059452 | 0.62 | — | — | |
| Ammonia Solution, Strong SCHEMBL29038378 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL30776679 | 0.62 | — | — | |
| SCHEMBL11027096 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL6441129 | 0.62 | — | — | |
| SCHEMBL2557723 | 0.62 | — | — | |
| SCHEMBL245451 | 0.60 | — | — | |
| Methanesulfonamide SCHEMBL28543975 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3180338-B1 | AZABENZIMIDAZOLE DERIVATIVES AS AMP PROTEIN KINASE AGONISTES | BOEHRINGER INGELHEIM INT (DE) | 2018-05-09 | — | — | EP | disclosed |