⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9250826 | 0.95 | — | — | |
| SCHEMBL9159951 | 0.94 | — | — | |
| SCHEMBL9164194 | 0.91 | ATP4A (0.60) | — | |
| SCHEMBL9158359 | 0.89 | — | — | |
| SCHEMBL9156572 | 0.85 | ATP4A (0.67) | — | |
| SCHEMBL9160371 | 0.84 | — | — | |
| SCHEMBL9160295 | 0.81 | — | — | |
| SCHEMBL9273781 | 0.81 | — | — | |
| SCHEMBL9268825 | 0.80 | — | — | |
| SCHEMBL9165521 | 0.79 | ATP4A (0.71) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0642500-A1 | 4-AMINO-3-ACYL QUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF GASTRIC ACID SECRETION | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 1995-03-15 | — | — | EP | disclosed |
| WO-1993012090-A1 | 4-AMINO-3-ACYL QUINOLINE DERIVATIVES AND THEIR USE AS INHIBITORS OF GASTRIC ACID SECRETION | SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) | 1993-06-24 | — | — | WO | disclosed |