Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | THRB | P10828 | 1/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | CASP1 | P29466 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.35 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.35 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12697206 | 0.80 | TDP1 (0.43) | ALDH1A1CYP3A4THRBALOX15TSHR | |
| SCHEMBL7865565 | 0.80 | L3MBTL1 (0.59) | TP53ALDH1A1HSP90AA1CYP3A4THRB | |
| SCHEMBL12695048 | 0.80 | TP53 (0.59) | TP53ALDH1A1HSP90AA1CYP3A4THRB | |
| SCHEMBL12695051 | 0.80 | TP53 (0.59) | TP53ALDH1A1HSP90AA1CYP3A4THRB | |
| SCHEMBL17461800 | 0.80 | ALDH1A1 (0.59) | TP53ALDH1A1HSP90AA1CYP3A4THRB | |
| SCHEMBL21276075 | 0.80 | ALDH1A1 (0.59) | TP53ALDH1A1HSP90AA1CYP3A4THRB | |
| SCHEMBL30797253 | 0.78 | NPSR1 (0.40) | TP53ALDH1A1HSP90AA1CYP3A4THRB | |
| SCHEMBL49805 | 0.77 | ALDH1A1 (1.00) | TP53ALDH1A1HSP90AA1CYP3A4THRB | |
| SCHEMBL15223665 | 0.77 | NPSR1 (0.41) | ALDH1A1SMN1; SMN2NPSR1SORT1KCNQ3 | |
| SCHEMBL5069800 | 0.76 | HDAC1 (0.38) | ALDH1A1SMN1; SMN2NPSR1SORT1KCNQ3 |
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-20120245136-A1 | CHROMAN-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED | 2012-09-27 | — | — | 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-20120245136-A1 | CHROMAN-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS | KCNJ2, KCNJ1, KCNC1 | TP53 4066/4885ALDH1A1 1764/4885HSP90AA1 1131/4885 |
“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.