Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.78 |
| ▸ | RELA | Q04206 | 9/20 | 0.58 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.54 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.53 |
| ▸ | ESR1 | P03372 | 2/20 | 0.53 |
| ▸ | ABL1 | P00519 | 1/20 | 0.53 |
| ▸ | TTR | P02766 | 1/20 | 0.53 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | BCR | P11274 | 1/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | NQO2 | P16083 | 1/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.53 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.53 |
| ▸ | TUBB | P07437 | 1/20 | 0.53 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.53 |
| ▸ | AHR | P35869 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5487752 | 1.00 | TRPA1 (0.78) | TRPA1RELATRPM8NFE2L2ESR1 | |
| SCHEMBL5493476 | 0.98 | TRPA1 (0.75) | TRPA1RELATRPM8NFE2L2ESR1 | |
| SCHEMBL5493474 | 0.98 | TRPA1 (0.75) | TRPA1RELATRPM8NFE2L2ESR1 | |
| SCHEMBL16492030 | 0.96 | TRPA1 (0.71) | TRPA1RELATRPM8NFE2L2ESR1 | |
| SCHEMBL8943882 | 0.96 | TRPA1 (0.71) | TRPA1RELATRPM8NFE2L2ESR1 | |
| SCHEMBL8943877 | 0.96 | TRPA1 (0.71) | TRPA1RELATRPM8NFE2L2ESR1 | |
| SCHEMBL7873582 | 0.96 | TRPA1 (0.71) | TRPA1RELATRPM8NFE2L2ESR1 | |
| SCHEMBL6819748 | 0.96 | TRPA1 (0.71) | TRPA1RELATRPM8NFE2L2ESR1 | |
| SCHEMBL4402914 | 0.96 | TRPA1 (0.71) | TRPA1RELATRPM8NFE2L2ESR1 | |
| SCHEMBL7821780 | 0.96 | TRPA1 (0.71) | TRPA1RELATRPM8NFE2L2ESR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7276627-B2 | One pot sequential reactions and novel products produced thereby | IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) | 2007-10-02 | — | — | US | disclosed |
| US-20060224017-A1 | One pot sequential reactions and novel products produced thereby | IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. | 2006-10-05 | — | — | 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-20060224017-A1 | One pot sequential reactions and novel products produced thereby | PNMT, CYP1A1, TERT | TRPA1 1677/4885RELA 1503/4885TRPM8 2842/4885 |
“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.