Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | FYN | P06241 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 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 | |
|---|---|---|---|---|
| SCHEMBL1279774 | 0.92 | CYP3A4 (0.47) | HSP90AA1NPSR1CYP3A4THRBTSHR | |
| SCHEMBL1279334 | 0.89 | HSP90AA1 (0.47) | HSP90AA1NPSR1CYP3A4THRBGAA | |
| SCHEMBL1279944 | 0.89 | HSP90AA1 (0.44) | HSP90AA1NPSR1CYP3A4THRBGAA | |
| SCHEMBL1279403 | 0.88 | CYP3A4 (0.49) | HSP90AA1NPSR1CYP3A4THRBTSHR | |
| SCHEMBL1280067 | 0.87 | CYP3A4 (0.44) | HSP90AA1NPSR1CYP3A4THRBGAA | |
| SCHEMBL9458158 | 0.86 | HSP90AA1 (0.53) | HSP90AA1NPSR1CYP3A4THRBGAA | |
| SCHEMBL1279489 | 0.84 | HSP90AA1 (0.47) | HSP90AA1NPSR1CYP3A4THRBTSHR | |
| SCHEMBL1280452 | 0.83 | CYP3A4 (0.49) | HSP90AA1NPSR1CYP3A4THRBTSHR | |
| SCHEMBL1279754 | 0.83 | CYP3A4 (0.46) | HSP90AA1NPSR1CYP3A4THRBGAA | |
| SCHEMBL1280062 | 0.82 | TNK2 (0.35) | TNK2 |
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-2443109-A1 | TRIAZOLE COMPOUNDS CARRYING A SULFUR SUBSTITUENT | BASF SE (DE) | 2012-04-25 | — | — | EP | disclosed |
| US-20120088663-A1 | Triazole Compounds Carrying a Sulfur Substituent | BASF SE (DE) | 2012-04-12 | — | — | US | disclosed |
| WO-2010146114-A1 | TRIAZOLE COMPOUNDS CARRYING A SULFUR SUBSTITUENT | BASF SE (DE) | 2010-12-23 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20120088663-A1 | Triazole Compounds Carrying a Sulfur Substituent | TST, STS, SQOR | HSP90AA1 3133/4885NPSR1 3019/4885CYP3A4 39/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.