Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | PPARG | P37231 | 5/20 | 0.32 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 4/20 | 0.31 |
| ▸ | NOS1 | P29475 | 2/20 | 0.30 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
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 SCHEMBL4524745 | 0.91 | NOS1 (0.35) | KCNH2CYP2D6DRD1HTR2AADORA1 | |
| Trifluoroacetic Acid SCHEMBL4528727 | 0.83 | KCNH2 (0.38) | KCNH2NLRP3TLR7 | |
| Trifluoroacetic Acid SCHEMBL4511571 | 0.82 | NOS1 (0.36) | KCNH2CYP2D6DRD1HTR2AADORA1 | |
| SCHEMBL4519079 | 0.82 | NLRP3 (0.38) | KCNH2CYP2D6DRD1HTR2AADORA1 | |
| Trifluoroacetic Acid SCHEMBL4526972 | 0.77 | PTPN1 (0.33) | KCNH2CYP2D6DRD1HTR2AADORA1 | |
| SCHEMBL4526032 | 0.75 | KCNH2 (0.44) | KCNH2CYP2D6DRD1HTR2AADORA1 | |
| SCHEMBL4514410 | 0.74 | KCNH2 (0.40) | KCNH2NLRP3TLR7 | |
| SCHEMBL4528751 | 0.74 | DHFR (0.39) | KCNH2CYP2D6DRD1HTR2AADORA1 | |
| SCHEMBL4523710 | 0.72 | PTPN1 (0.43) | KCNH2PPARGCYP2D6NLRP3TLR7 | |
| SCHEMBL4524484 | 0.72 | PTPN1 (0.52) | CYP2D6 |
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-20090105477-A1 | Quinazoline Protein Tyrosine Phosphatase Inhibitors | BERTHEL STEVEN JOSEPH | 2009-04-23 | — | — | US | disclosed |
| EP-1812409-A1 | AMINOQUINAZOLINES COMPOUNDS | F. Hoffmann-Roche AG (CH) | 2007-08-01 | — | — | EP | disclosed |
| WO-2006050843-A1 | AMINOQUINAZOLINES COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-05-18 | — | — | 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-20090105477-A1 | Quinazoline Protein Tyrosine Phosphatase Inhibitors | PTPN5, PTPN1, PTPN7 | KCNH2 3854/4885PPARG 928/4885PLA2G2A 3534/4885 |
“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.