Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB8 | P28062 | 2/20 | 0.36 |
| ▸ | PFKFB2 | O60825 | 1/20 | 0.34 |
| ▸ | PFKFB1 | P16118 | 1/20 | 0.34 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | EP300 | Q09472 | 2/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.32 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL895804 | 0.87 | KCNH2 (0.42) | STAT3ALDH1A1GAAKCNH2CYP3A4 | |
| SCHEMBL895802 | 0.87 | KCNH2 (0.42) | STAT3ALDH1A1GAAKCNH2CYP3A4 | |
| SCHEMBL16309238 | 0.82 | STAT3 (0.39) | STAT3ALDH1A1GAAKCNH2CYP3A4 | |
| SCHEMBL896081 | 0.81 | KCNH2 (0.39) | PSMB8ALDH1A1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL896062 | 0.81 | F2 (0.43) | ALDH1A1KCNH2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL894831 | 0.80 | KCNH2 (0.45) | ALDH1A1GAAKCNH2CYP3A4CYP2C9 | |
| SCHEMBL16309207 | 0.79 | KCNH2 (0.49) | ALDH1A1GAAKCNH2CYP3A4CYP2C9 | |
| SCHEMBL895147 | 0.79 | KCNH2 (0.37) | ALDH1A1KCNH2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL895420 | 0.78 | KCNH2 (0.38) | KCNH2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL894832 | 0.73 | KCNH2 (0.39) | ALDH1A1GAAKCNH2CYP3A4CYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150246917-A1 | INHIBITORS OF HEPATITIS C VIRUS REPLICATION | MERCK SHARP & DOHME CORP. (US) | 2015-09-03 | — | — | US | 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-20150246917-A1 | INHIBITORS OF HEPATITIS C VIRUS REPLICATION | HAVCR2, HCCS, EIF2AK2 | PSMB8 985/4885PFKFB2 3322/4885PFKFB1 2986/4885 |
“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.