⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4735174 | 1.00 | — | — | |
| SCHEMBL4986503 | 0.86 | — | — | |
| SCHEMBL4730820 | 0.85 | — | — | |
| SCHEMBL4733504 | 0.85 | — | — | |
| SCHEMBL4591277 | 0.80 | ATP4A (0.36) | — | |
| SCHEMBL4591325 | 0.80 | ATP4A (0.36) | — | |
| SCHEMBL5989299 | 0.80 | ATP4A (0.36) | — | |
| SCHEMBL4731626 | 0.77 | ATP4A (0.35) | — | |
| SCHEMBL4735663 | 0.77 | ATP4A (0.35) | — | |
| SCHEMBL4731646 | 0.77 | RET (0.36) | — |
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-2008058990-A1 | 7,7-DISUBSTITUTED PYRANO-[2,3-C]-IMIDAZO-[1,2-A]-PYRIDINE DERIVATIVES AND THEIR USE AS GASTRIC ACID SECRETION INHIBITORS | NYCOMED GMBH (DE) | 2008-05-22 | — | — | WO | disclosed |