Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 5/20 | 0.49 |
| ▸ | CA1 | P00915 | 8/20 | 0.40 |
| ▸ | CA2 | P00918 | 8/20 | 0.40 |
| ▸ | TTR | P02766 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | CDC25A | P30304 | 1/20 | 0.35 |
| ▸ | CDC25C | P30307 | 1/20 | 0.35 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5993039 | 0.84 | AHR (0.53) | AHRCA1CA2TTRMCL1 | |
| SCHEMBL2963729 | 0.76 | AHR (0.54) | AHRCA1CA2TTRMCL1 | |
| SCHEMBL21191893 | 0.73 | AHR (0.59) | AHRCA1CA2TTRMCL1 | |
| SCHEMBL19502219 | 0.73 | AHR (0.63) | AHRCA1CA2TTRMCL1 | |
| SCHEMBL5992003 | 0.71 | AHR (0.44) | AHRCA1CA2TTRMCL1 | |
| SCHEMBL21110463 | 0.70 | AHR (0.59) | AHRTTRMCL1 | |
| SCHEMBL31006411 | 0.70 | AHR (0.59) | AHRTTRMCL1 | |
| SCHEMBL21669068 | 0.70 | AHR (0.59) | AHRCA1CA2TTRMCL1 | |
| SCHEMBL29450776 | 0.70 | AHR (0.59) | AHRCA1CA2TTRMCL1 | |
| SCHEMBL2966509 | 0.70 | AHR (0.59) | AHRCA1CA2TTRMCL1 |
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-1735300-A1 | THIO-SUBSTITUTED TRICYCLIC AND BICYCLIC AROMATIC METHANESULFINYL DERIVATIVES | CEPHALON FRANCE (FR) | 2006-12-27 | — | — | EP | disclosed |
| WO-2005100345-A1 | THIO-SUBSTITUTED TRICYCLIC AND BICYCLIC AROMATIC METHANESULFINYL DERIVATIVES | CEPHALON FRANCE (FR) | 2005-10-27 | — | — | WO | disclosed |