Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 18/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4885746 | 0.99 | CXCR4 (0.53) | CXCR4CHRM2CYP2D6DRD2OPRM1 | |
| SCHEMBL4890137 | 0.94 | CXCR4 (0.51) | CXCR4CHRM2CYP2D6DRD2OPRM1 | |
| SCHEMBL4884816 | 0.92 | CXCR4 (0.55) | CXCR4CHRM2CYP2D6DRD2OPRM1 | |
| SCHEMBL4886406 | 0.91 | CXCR4 (0.57) | CXCR4CHRM2CYP2D6DRD2OPRM1 | |
| SCHEMBL4886885 | 0.89 | CXCR4 (0.57) | CXCR4CHRM2CYP2D6DRD2OPRM1 | |
| SCHEMBL4891093 | 0.89 | CXCR4 (0.47) | CXCR4 | |
| SCHEMBL4884751 | 0.88 | CXCR4 (0.48) | CXCR4KCNH2 | |
| SCHEMBL14270097 | 0.88 | CXCR4 (0.53) | CXCR4CHRM2CYP2D6DRD2OPRM1 | |
| SCHEMBL4882171 | 0.88 | CXCR4 (0.48) | CXCR4KCNH2 | |
| SCHEMBL14270093 | 0.88 | CXCR4 (0.48) | CXCR4KCNH2 |
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-20080045537-A1 | Chemical Compounds | SMITHKLINE BEECHAM CORPORATION | 2008-02-21 | — | — | 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-20080045537-A1 | Chemical Compounds | CCR5, CXCR4, CXCR3 | CXCR4 2/4885CHRM2 3578/4885CYP2D6 4070/4885 |
“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.