Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 12/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.43 |
| ▸ | CYP8B1 | Q9UNU6 | 2/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | FYN | P06241 | 2/20 | 0.34 |
| ▸ | CYP51A1 | Q16850 | 2/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 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 | |
|---|---|---|---|---|
| SCHEMBL17832624 | 1.00 | CYP3A4 (0.43) | CYP3A4ABCG2ABCB11CYP8B1CYP17A1 | |
| SCHEMBL17824324 | 1.00 | CYP3A4 (0.43) | CYP3A4ABCG2ABCB11CYP8B1CYP17A1 | |
| SCHEMBL23355853 | 0.92 | ABCB11 (0.37) | CYP3A4ABCG2ABCB11CYP8B1CYP17A1 | |
| Pramiconazole SCHEMBL3048307 | 0.90 | CYP3A4 (0.55) | CYP3A4ABCG2ABCB11CYP8B1CYP17A1 | |
| Pramiconazole SCHEMBL3048310 | 0.90 | CYP3A4 (0.55) | CYP3A4ABCG2ABCB11CYP8B1CYP17A1 | |
| Pramiconazole SCHEMBL6152243 | 0.89 | CYP3A4 (0.55) | CYP3A4ABCG2ABCB11CYP8B1CYP17A1 | |
| Pramiconazole SCHEMBL6152244 | 0.89 | CYP3A4 (0.55) | CYP3A4ABCG2ABCB11CYP8B1CYP17A1 | |
| SCHEMBL19730448 | 0.85 | GRM2 (0.34) | CYP3A4ABCG2ABCB11CYP8B1CYP17A1 | |
| SCHEMBL19730471 | 0.85 | GRM2 (0.34) | CYP3A4ABCG2ABCB11CYP8B1CYP17A1 | |
| SCHEMBL19730455 | 0.85 | CYP3A4 (0.53) | CYP3A4ABCG2ABCB11CYP8B1CYP17A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170362211-A1 | SMALL MOLECULE INHIBITORS OF FIBROSIS | THE SCRIPPS RESEARCH INSTITUTE | 2017-12-21 | — | — | US | disclosed |
| US-20170362211-A1 | SMALL MOLECULE INHIBITORS OF FIBROSIS | THE SCRIPPS RESEARCH INSTITUTE | 2017-12-21 | — | — | 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-20170362211-A1 | SMALL MOLECULE INHIBITORS OF FIBROSIS | MMP1, COL2A1, MMP8 | CYP3A4 4660/4885ABCG2 3265/4885ABCB11 2310/4885 |
“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.