Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.77 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | VEGFA | P15692 | 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 | |
|---|---|---|---|---|
| SCHEMBL4805825 | 0.92 | CYP3A4 (0.87) | CYP3A4CYP2C9CYP2C19KCNH2MTNR1B | |
| SCHEMBL4806366 | 0.91 | CYP3A4 (0.65) | CYP3A4CYP2C9CYP2C19KCNH2EPAS1 | |
| SCHEMBL4810352 | 0.90 | CYP3A4 (0.68) | CYP3A4CYP2C9CYP2C19KCNH2MTNR1B | |
| SCHEMBL4807848 | 0.90 | CYP3A4 (0.63) | CYP3A4CYP2C9CYP2C19KCNH2MTNR1B | |
| SCHEMBL5319854 | 0.90 | CYP3A4 (0.62) | CYP3A4CYP2C9CYP2C19KCNH2MTNR1B | |
| SCHEMBL14262139 | 0.87 | CYP3A4 (1.00) | CYP3A4CYP2C9CYP2C19KCNH2MTNR1B | |
| SCHEMBL11904806 | 0.86 | CYP3A4 (0.58) | CYP3A4CYP2C9CYP2C19KCNH2EPAS1 | |
| SCHEMBL11904805 | 0.84 | CYP3A4 (0.56) | CYP3A4CYP2C9CYP2C19KCNH2EPAS1 | |
| SCHEMBL4808072 | 0.83 | CYP3A4 (0.73) | CYP3A4CYP2C9CYP2C19KCNH2MTNR1B | |
| SCHEMBL3666833 | 0.83 | CYP3A4 (0.54) | CYP3A4CYP2C9CYP2C19KCNH2EPAS1 |
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-7348345-B2 | Nonnucleoside reverse transcriptase inhibitors | ROCHE PALO ALTO LLC (US) | 2008-03-25 | — | — | US | disclosed |
| US-20070179157-A1 | Nonnucleoside reverse transcriptase inhibitors | DUNN JAMES P | 2007-08-02 | — | — | US | disclosed |
| US-7208509-B2 | Non-nucleoside reverse transcriptase inhibitors | ROCHE PALO ALTO LLC (US) | 2007-04-24 | — | — | 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-20070179157-A1 | Nonnucleoside reverse transcriptase inhibitors | RRM2, RRM2B, SAMHD1 | CYP3A4 438/4885CYP2C9 1755/4885CYP2C19 1377/4885 |
“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.