Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | NPFFR1 | Q9GZQ6 | 9/20 | 0.52 |
| ▸ | NPFFR2 | Q9Y5X5 | 9/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.52 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NPY2R | P49146 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16876704 | 0.90 | CYP2D6 (0.59) | CYP2D6ALDH1A1NPFFR1NPFFR2OPRK1 | |
| SCHEMBL16876688 | 0.89 | ALDH1A1 (0.56) | CYP2D6ALDH1A1NPFFR1NPFFR2OPRK1 | |
| SCHEMBL16876740 | 0.88 | CYP2D6 (0.60) | CYP2D6ALDH1A1NPFFR1NPFFR2OPRK1 | |
| SCHEMBL20187091 | 0.87 | ALDH1A1 (0.56) | CYP2D6ALDH1A1NPFFR1NPFFR2OPRK1 | |
| SCHEMBL2996293 | 0.85 | CYP2D6 (0.68) | CYP2D6ALDH1A1NPFFR1NPFFR2OPRK1 | |
| SCHEMBL5556286 | 0.85 | ALDH1A1 (0.61) | CYP2D6ALDH1A1NPFFR1NPFFR2OPRK1 | |
| SCHEMBL16876691 | 0.84 | CYP2D6 (0.58) | CYP2D6ALDH1A1NPFFR1NPFFR2OPRK1 | |
| SCHEMBL20187134 | 0.84 | CYP2D6 (0.58) | CYP2D6ALDH1A1NPFFR1NPFFR2OPRK1 | |
| SCHEMBL654357 | 0.83 | ALDH1A1 (0.62) | CYP2D6ALDH1A1NPFFR1NPFFR2OPRK1 | |
| SCHEMBL16876743 | 0.81 | CYP2D6 (0.57) | CYP2D6ALDH1A1NPFFR1NPFFR2OPRK1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10428049-B2 | TRPA1 modulators | ALGOMEDIX, INC. (US) | 2019-10-01 | — | — | US | disclosed |
| US-20190016701-A1 | TRPA1 MODULATORS | ALGOMEDIX, INC. (US) | 2019-01-17 | — | — | US | disclosed |
| US-9951046-B2 | TRPA1 modulators | ALGOMEDIX, INC. (US) | 2018-04-24 | — | — | US | disclosed |
| US-9951046-B2 | TRPA1 modulators | ALGOMEDIX, INC. (US) | 2018-04-24 | — | — | US | disclosed |
| US-20170001983-A1 | TRPA1 MODULATORS | ALGOMEDIX, INC. | 2017-01-05 | — | — | US | disclosed |
| US-20170001983-A1 | TRPA1 MODULATORS | ALGOMEDIX, INC. | 2017-01-05 | — | — | 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 (3 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-10428049-B2 | TRPA1 modulators | TRPA1, TRPV1, TRPV2 | CYP2D6 2163/4885ALDH1A1 1436/4885NPFFR1 270/4885 |
| US-20170001983-A1 | TRPA1 MODULATORS | TRPA1, TRPV1, TRPV2 | CYP2D6 2163/4885ALDH1A1 1436/4885NPFFR1 270/4885 |
| US-20190016701-A1 | TRPA1 MODULATORS | TRPA1, TRPV1, TRPV2 | CYP2D6 2163/4885ALDH1A1 1436/4885NPFFR1 270/4885 |
“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.