Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.37 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.37 |
| ▸ | DYRK3 | O43781 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL4089468 | 1.00 | CISD1 (0.39) | CISD1MAPTORAI1ANO1DYRK3 | |
| SCHEMBL2996046 | 0.96 | CISD1 (0.42) | CISD1MAPTORAI1ANO1DYRK3 | |
| SCHEMBL2996047 | 0.96 | CISD1 (0.42) | CISD1MAPTORAI1ANO1DYRK3 | |
| Trifluoroacetic Acid SCHEMBL4099194 | 0.89 | ALOX5 (0.43) | CISD1MAPTDYRK3HDAC3CDK1 | |
| Trifluoroacetic Acid SCHEMBL4099206 | 0.89 | ALOX5 (0.43) | CISD1MAPTDYRK3HDAC3CDK1 | |
| Trifluoroacetic Acid SCHEMBL4095087 | 0.86 | PABPC1 (0.48) | MAPTDYRK3CDK1ALDH1A1CYP3A4 | |
| Trifluoroacetic Acid SCHEMBL4095081 | 0.86 | PABPC1 (0.48) | MAPTDYRK3CDK1ALDH1A1CYP3A4 | |
| Trifluoroacetic Acid SCHEMBL4088836 | 0.86 | DYRK3 (0.38) | CISD1DYRK3CDK1ALDH1A1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL4088829 | 0.86 | DYRK3 (0.38) | CISD1DYRK3CDK1ALDH1A1CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL4093888 | 0.86 | OGA (0.40) | MAPTDYRK3ALDH1A1TSHRPIK3CD |
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 |
|---|---|---|---|---|---|---|---|
| US-20090203692-A1 | NOVEL CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION | 2009-08-13 | — | — | US | disclosed |
| EP-1885362-A2 | NOVEL CHEMICAL COMPOUNDS | Smithkline Beecham Corporation (US) | 2008-02-13 | — | — | EP | disclosed |
| WO-2006127458-A2 | NOVEL CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-11-30 | — | — | 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-20090203692-A1 | NOVEL CHEMICAL COMPOUNDS | HIPK3, HIPK1, HIPK4 | CISD1 3112/4885MAPT 1880/4885ORAI1 4830/4885 |
“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.