⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3378607 | 0.90 | KCNH2 (0.31) | — | |
| SCHEMBL3376345 | 0.89 | MEN1 (0.32) | — | |
| SCHEMBL21820230 | 0.80 | — | — | |
| SCHEMBL30366404 | 0.80 | — | — | |
| SCHEMBL13425000 | 0.78 | USP2 (0.33) | — | |
| SCHEMBL21820265 | 0.78 | TTR (0.32) | — | |
| SCHEMBL21820321 | 0.78 | — | — | |
| SCHEMBL30236725 | 0.78 | — | — | |
| SCHEMBL3375288 | 0.77 | DPP4 (0.31) | — | |
| SCHEMBL3374526 | 0.77 | PIK3CA (0.31) | — |
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-2010046388-A1 | SUBSTITUTED (AZA) -1-METHYL-1H-QUINOLIN-2-ONES AS ANTIBACTERIALS | GLAXO GROUP LIMITED (GB) | 2010-04-29 | — | — | WO | disclosed |