Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27639433 | 0.81 | — | — | |
| SCHEMBL7553897 | 0.73 | — | — | |
| SCHEMBL6283902 | 0.73 | — | — | |
| SCHEMBL29040693 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL7554361 | 0.70 | — | — | |
| SCHEMBL16877704 | 0.69 | CXCR4 (0.44) | CXCR4SMN1; SMN2ALDH1A1 | |
| SCHEMBL16877866 | 0.67 | SMN1; SMN2 (0.41) | CXCR4SMN1; SMN2ALDH1A1 | |
| SCHEMBL21483242 | 0.67 | CXCR4 (0.41) | CXCR4SMN1; SMN2ALDH1A1 | |
| SCHEMBL16878844 | 0.65 | SMN1; SMN2 (0.39) | CXCR4SMN1; SMN2ALDH1A1 | |
| SCHEMBL316126 | 0.64 | CXCR4 (0.89) | CXCR4SMN1; SMN2ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101203520-A | Process for the preparation of 3,7-dihydroxy-1,5-diazacyclooctanes | ASTRAZENECA AB (SE) | 2008-06-18 | — | — | CN | disclosed |
| CN-1267435-C | Novel process for preparing oxabispidines | ASTRAZENECA AB (SE) | 2006-08-02 | — | — | CN | disclosed |
| CN-1520417-A | New process for prepn. of oxabispidines | — | 2004-08-11 | — | — | CN | disclosed |
| EP-1385851-A1 | NEW PROCESS FOR THE PREPARATION OF OXABISPIDINES | AstraZeneca AB (SE) | 2004-02-04 | — | — | EP | disclosed |
| WO-2002083691-A1 | NEW PROCESS FOR THE PREPARATION OF OXABISPIDINES | ASTRAZENECA AB (SE) | 2002-10-24 | — | — | WO | disclosed |