Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL4303353 | 1.00 | ITGA4 (0.53) | ITGA4ITGB1 | |
| SCHEMBL13932617 | 0.92 | CYP3A4 (0.51) | ITGA4ITGB1 | |
| SCHEMBL4314579 | 0.87 | ITGA4 (0.66) | ITGA4ITGB1 | |
| SCHEMBL4305499 | 0.83 | ITGA4 (0.65) | ITGA4ITGB1 | |
| SCHEMBL6478264 | 0.83 | ITGA4 (0.54) | ITGA4ITGB1 | |
| SCHEMBL13953147 | 0.81 | CYP3A4 (0.55) | ITGA4ITGB1 | |
| SCHEMBL13913379 | 0.80 | CYP3A4 (0.64) | ITGA4ITGB1 | |
| SCHEMBL4316900 | 0.80 | CYP3A4 (0.64) | ITGA4ITGB1 | |
| SCHEMBL8250435 | 0.79 | ITGA4 (0.59) | ITGA4ITGB1 | |
| Hydrochloric Acid SCHEMBL4313669 | 0.78 | ITGA4 (0.58) | ITGA4ITGB1 |
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-20090048308-A1 | VLA-4 Antagonists | MERCK SHARP & DOHME CORP. | 2009-02-19 | — | — | 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-20090048308-A1 | VLA-4 Antagonists | VCAM1, SELPLG, ITGA4 | ITGA4 3/4885ITGB1 15/4885 |
“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.