Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 11/20 | 0.58 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | USP19 | O94966 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8105937 | 0.86 | SIGMAR1 (0.56) | SIGMAR1ALDH1A1 | |
| SCHEMBL8908632 | 0.86 | SIGMAR1 (0.56) | SIGMAR1ALDH1A1 | |
| SCHEMBL8105933 | 0.86 | SIGMAR1 (0.56) | SIGMAR1ALDH1A1 | |
| SCHEMBL8909799 | 0.75 | SIGMAR1 (0.43) | SIGMAR1 | |
| SCHEMBL5499445 | 0.74 | SIGMAR1 (0.47) | SIGMAR1 | |
| SCHEMBL8098741 | 0.73 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL8096984 | 0.73 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL8098963 | 0.73 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL8105601 | 0.73 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL8099211 | 0.73 | SIGMAR1 (1.00) | SIGMAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0661271-B1 | AZEPINE DERIVATIVES, PRODUCTION THEREOF, AND USE THEREOF AS SIGMA-RECEPTOR LIGANDS | ASAHI CHEMICAL IND (JP) | 2000-04-26 | — | — | EP | disclosed |
| US-5658923-A | USED IN TREATING DISEASES RELATED TO SIGMA-RECEPTOR, SUCH AS SCHIZOPHRENIA | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1997-08-19 | — | — | US | disclosed |
| EP-0661271-A1 | AZEPINE DERIVATIVE, PRODUCTION THEREOF, AND USE THEREOF | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1995-07-05 | — | — | EP | disclosed |