Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | NTMT1 | Q9BV86 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9330841 | 0.93 | SMN1; SMN2 (0.48) | SMN1; SMN2HTTL3MBTL1CYP2D6POLB | |
| SCHEMBL9333430 | 0.85 | CHRM3 (0.38) | SMN1; SMN2EPHX1MEN1KMT2AALDH1A1 | |
| SCHEMBL9330747 | 0.81 | SMN1; SMN2 (0.43) | SMN1; SMN2HTTL3MBTL1CYP2D6POLB | |
| SCHEMBL9333182 | 0.80 | SMN1; SMN2 (0.55) | SMN1; SMN2HTTL3MBTL1CYP2D6POLB | |
| SCHEMBL9329947 | 0.79 | MEN1 (0.35) | EPHX1MEN1KMT2AALDH1A1 | |
| SCHEMBL9329952 | 0.79 | SMN1; SMN2 (0.45) | SMN1; SMN2HTTL3MBTL1CYP2D6POLB | |
| SCHEMBL9330460 | 0.78 | GAA (0.40) | EPHX1MEN1KMT2AALDH1A1 | |
| SCHEMBL9330164 | 0.76 | CHRM3 (0.46) | EPHX1 | |
| SCHEMBL9333382 | 0.75 | MEN1 (0.36) | CYP2D6EPHX1MEN1KMT2AALDH1A1 | |
| Fumaric Acid SCHEMBL9346169 | 0.74 | ITGB3 (0.42) | CYP2D6ALDH1A1CYP3A4 |
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 |