⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12910975 | 0.93 | — | — | |
| SCHEMBL2724208 | 0.91 | — | — | |
| SCHEMBL7466909 | 0.89 | — | — | |
| SCHEMBL692771 | 0.89 | — | — | |
| SCHEMBL12100658 | 0.87 | — | — | |
| SCHEMBL3268716 | 0.87 | — | — | |
| SCHEMBL1892386 | 0.85 | — | — | |
| SCHEMBL13934752 | 0.84 | CRHR1 (0.32) | — | |
| SCHEMBL444921 | 0.83 | CRHR1 (0.33) | — | |
| SCHEMBL9926865 | 0.83 | CRHR1 (0.33) | — |
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-1807395-B1 | PROCESS FOR THE SYNTHESIS OF N-ALKOXYAMINES | BASF SE (DE) | 2015-12-23 | — | — | EP | disclosed |