Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 17/20 | 0.64 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.41 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3993692 | 0.97 | CXCR4 (0.64) | CXCR4KCNH2ALDH1A1 | |
| SCHEMBL4939521 | 0.92 | CXCR4 (0.74) | CXCR4KCNH2 | |
| SCHEMBL4933416 | 0.91 | CXCR4 (0.71) | CXCR4KCNH2 | |
| SCHEMBL3993485 | 0.91 | CXCR4 (0.73) | CXCR4KCNH2 | |
| SCHEMBL4935819 | 0.90 | CXCR4 (0.72) | CXCR4KCNH2 | |
| SCHEMBL3993351 | 0.87 | CXCR4 (0.72) | CXCR4KCNH2 | |
| SCHEMBL4935883 | 0.87 | CXCR4 (0.63) | CXCR4KCNH2 | |
| SCHEMBL4284011 | 0.86 | CXCR4 (0.62) | CXCR4NOD2NOD1 | |
| SCHEMBL3993737 | 0.85 | CXCR4 (0.65) | CXCR4KCNH2 | |
| SCHEMBL4938187 | 0.85 | CXCR4 (0.60) | CXCR4 |
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-20080096861-A1 | Chemical Compounds | SMITHKLINE BEECHAM CORPORATION (US) | 2008-04-24 | — | — | 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-20080096861-A1 | Chemical Compounds | CCR5, CXCR4, CXCR3 | CXCR4 2/4885KCNH2 4733/4885NOD2 1885/4885 |
“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.