Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL445217 | 0.74 | ALDH1A1 (0.39) | ALDH1A1NQO2 | |
| SCHEMBL9634396 | 0.71 | ALDH1A1 (0.36) | ALDH1A1NQO2 | |
| SCHEMBL277279 | 0.70 | MAPK1 (0.36) | ALDH1A1 | |
| SCHEMBL432652 | 0.67 | MAPK1 (0.33) | ALDH1A1 | |
| SCHEMBL8422038 | 0.67 | CYP2A6 (0.35) | ALDH1A1 | |
| SCHEMBL707057 | 0.66 | NR1H2 (0.30) | — | |
| SCHEMBL31168893 | 0.66 | ALDH1A1 (0.43) | ALDH1A1NQO2 | |
| SCHEMBL3761218 | 0.66 | ALDH1A1 (0.43) | ALDH1A1NQO2 | |
| SCHEMBL5089853 | 0.64 | NQO2 (0.37) | ALDH1A1NQO2 | |
| Methoxymethane SCHEMBL28099062 | 0.64 | ALDH1A1 (0.53) | ALDH1A1NQO2 |
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-0728140-A1 | NEW STEROIDS WITH RADICAL-ATTRACTING AROMATIC SUBSTITUENTS, PROCESS FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL COMPOUNDS CONTAINING THE SAID SUBSTANCES | Jenapharm GmbH & Co. KG (DE) | 1996-08-28 | — | — | EP | disclosed |
| WO-1995013287-A1 | NEW STEROIDS WITH RADICAL-ATTRACTING AROMATIC SUBSTITUENTS, PROCESS FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL COMPOUNDS CONTAINING THE SAID SUBSTANCES | JENAPHARM GMBH (DE) | 1995-05-18 | — | — | WO | disclosed |