Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 10/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL9330490 | 0.90 | ALOX15 (0.41) | CHRM3 | |
| Fumaric Acid SCHEMBL9345668 | 0.89 | CHRM3 (0.40) | CHRM3 | |
| SCHEMBL5148816 | 0.83 | GSR (0.35) | — | |
| SCHEMBL9330759 | 0.81 | GNAO1 (0.50) | CHRM3 | |
| SCHEMBL5154489 | 0.79 | SLC18A3 (0.38) | SMN1; SMN2 | |
| SCHEMBL9330677 | 0.79 | HRH3 (0.40) | SMN1; SMN2CHRM3 | |
| SCHEMBL5153918 | 0.79 | GSR (0.33) | — | |
| Fumaric Acid SCHEMBL9348851 | 0.79 | CHRM3 (0.38) | CHRM3 | |
| SCHEMBL4587607 | 0.78 | KDM4E (0.38) | SMN1; SMN2CHRM3 | |
| SCHEMBL9333108 | 0.78 | ACHE (0.40) | KEAP1SMN1; SMN2 |
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-0366004-B1 | Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof | BOEHRINGER MANNHEIM GMBH (DE) | 1994-03-30 | — | — | EP | disclosed |
| EP-0366004-A1 | Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof | Roche Diagnostics GmbH (DE) | 1990-05-02 | — | — | EP | disclosed |