⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1037142 | 0.65 | — | — | |
| SCHEMBL11546268 | 0.64 | — | — | |
| SCHEMBL20881605 | 0.61 | — | — | |
| SCHEMBL25147664 | 0.58 | — | — | |
| SCHEMBL3173803 | 0.57 | — | — | |
| SCHEMBL4477483 | 0.55 | — | — | |
| SCHEMBL67632 | 0.55 | — | — | |
| SCHEMBL1862873 | 0.55 | — | — | |
| SCHEMBL21983475 | 0.54 | — | — | |
| SCHEMBL5797902 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4139537-A | 3-Aryloxy-1-(2- or 4-iminodihydro-1-pyridyl)-2-propanol antiarrhythmic compounds | COOPER LABORATORIES, INC. (US) | 1979-02-13 | — | — | US | disclosed |