Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 20/20 | 0.90 |
| ▸ | MAPT | P10636 | 3/20 | 0.81 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.81 |
| ▸ | MEN1 | O00255 | 2/20 | 0.81 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.81 |
| ▸ | LMNA | P02545 | 2/20 | 0.81 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.81 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.81 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.81 |
| ▸ | CYP51A1 | Q16850 | 2/20 | 0.81 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.81 |
| ▸ | CYP8B1 | Q9UNU6 | 2/20 | 0.81 |
| ▸ | FYN | P06241 | 1/20 | 0.81 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.81 |
| ▸ | TACR1 | P25103 | 1/20 | 0.81 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.81 |
| ▸ | CCR4 | P51679 | 1/20 | 0.81 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.81 |
| ▸ | CYP21A2 | P08686 | 6/20 | 0.72 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.72 |
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 | |
|---|---|---|---|---|
| SCHEMBL20710056 | 1.00 | CYP3A4 (0.90) | CYP3A4MAPTMAPK1MEN1ABCB11 | |
| SCHEMBL31330298 | 1.00 | CYP3A4 (0.90) | CYP3A4MAPTMAPK1MEN1ABCB11 | |
| SCHEMBL20710020 | 1.00 | CYP3A4 (0.90) | CYP3A4MAPTMAPK1MEN1ABCB11 | |
| SCHEMBL31330271 | 1.00 | CYP3A4 (0.90) | CYP3A4MAPTMAPK1MEN1ABCB11 | |
| SCHEMBL17739444 | 1.00 | CYP3A4 (0.90) | CYP3A4MAPTMAPK1MEN1ABCB11 | |
| SCHEMBL20710079 | 1.00 | CYP3A4 (0.90) | CYP3A4MAPTMAPK1MEN1ABCB11 | |
| SCHEMBL11078787 | 0.95 | CYP3A4 (0.81) | CYP3A4MAPTMAPK1MEN1ABCB11 | |
| SCHEMBL11078785 | 0.95 | CYP3A4 (0.81) | CYP3A4MAPTMAPK1MEN1ABCB11 | |
| SCHEMBL24335660 | 0.95 | CYP3A4 (1.00) | CYP3A4MAPTMAPK1MEN1ABCB11 | |
| SCHEMBL20710042 | 0.95 | CYP3A4 (1.00) | CYP3A4MAPTMAPK1MEN1ABCB11 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3626242-A1 | ITRACONAZOLE ANALOGS AS INHIBITORS OF FIBROSIS | The Scripps Research Institute (US) | 2020-03-25 | — | — | EP | disclosed |
| US-20170217943-A1 | SMALL MOLECULE INHIBITORS OF FIBROSIS | THE SCRIPPS RESEARCH INSTITUTE | 2017-08-03 | — | — | US | disclosed |
| US-20170217943-A1 | SMALL MOLECULE INHIBITORS OF FIBROSIS | THE SCRIPPS RESEARCH INSTITUTE | 2017-08-03 | — | — | US | disclosed |
| US-20160130258-A1 | SMALL MOLECULE INHIBITORS OF FIBROSIS | THE SCRIPPS RESEARCH INSTITUTE | 2016-05-12 | — | — | US | disclosed |
| US-20160130258-A1 | SMALL MOLECULE INHIBITORS OF FIBROSIS | THE SCRIPPS RESEARCH INSTITUTE | 2016-05-12 | — | — | 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 (2 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-20160130258-A1 | SMALL MOLECULE INHIBITORS OF FIBROSIS | MMP1, COL2A1, MMP8 | CYP3A4 4660/4885MAPT 4142/4885MAPK1 1794/4885 |
| US-20170217943-A1 | SMALL MOLECULE INHIBITORS OF FIBROSIS | MMP1, COL2A1, MMP8 | CYP3A4 4660/4885MAPT 4142/4885MAPK1 1794/4885 |
“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.