Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | CD44 | P16070 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4651298 | 0.89 | TDP2 (0.34) | — | |
| SCHEMBL4652401 | 0.89 | CD44 (0.37) | PDK2CD44 | |
| SCHEMBL7084327 | 0.72 | TDP2 (0.35) | — | |
| Hydrochloric Acid SCHEMBL6905758 | 0.64 | PDK2 (0.32) | PDK2CD44 | |
| SCHEMBL3353069 | 0.62 | PDK2 (0.33) | PDK2CD44 | |
| SCHEMBL6418458 | 0.61 | ALDH1A1 (0.40) | PDK2 | |
| SCHEMBL15313038 | 0.61 | TDP2 (0.52) | TRPA1ATM | |
| SCHEMBL28613659 | 0.60 | HTR7 (0.49) | PDK2CD44TRPA1ATM | |
| SCHEMBL4071459 | 0.59 | TRPA1 (0.55) | CD44TRPA1ATM | |
| SCHEMBL4021982 | 0.58 | ACHE (0.57) | CD44TRPA1ATM |
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-20010039349-A1 | Selective, Catalytic, thermal functionalization of secondary or aromatic C-H cyclic hydrocarbon bonds | SHELL OIL COMPANY | 2001-11-08 | — | — | US | claimed |
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-20010039349-A1 | Selective, Catalytic, thermal functionalization of secondary or aromatic C-H cyclic hydrocarbon bonds | AHR, PAH, HRH3 | PDK2 2050/4885CD44 349/4885TRPA1 472/4885 |
“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.