Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.70 |
| ▸ | GAA | P10253 | 1/20 | 0.67 |
| ▸ | RECQL | P46063 | 1/20 | 0.66 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.65 |
| ▸ | CTSL | P07711 | 1/20 | 0.64 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL14714625 | 0.98 | ALDH1A1 (0.68) | ALDH1A1GAARECQLKEAP1CTSL | |
| Hydrochloric Acid SCHEMBL8046034 | 0.97 | ALDH1A1 (0.66) | ALDH1A1GAARECQLKEAP1CTSL | |
| SCHEMBL11355240 | 0.95 | ALDH1A1 (0.77) | ALDH1A1GAARECQLKEAP1CTSL | |
| SCHEMBL31241520 | 0.86 | ALDH1A1 (0.74) | ALDH1A1GAARECQLKEAP1CTSL | |
| SCHEMBL525353 | 0.86 | ALDH1A1 (0.74) | ALDH1A1GAARECQLKEAP1CTSL | |
| SCHEMBL11662841 | 0.83 | SMN1; SMN2 (0.61) | ALDH1A1GAARECQLKEAP1CTSL | |
| SCHEMBL38659518 | 0.82 | ALDH1A1 (1.00) | ALDH1A1GAARECQLKEAP1CTSL | |
| SCHEMBL18050211 | 0.82 | ALDH1A1 (0.79) | ALDH1A1GAARECQLKEAP1CTSL | |
| SCHEMBL5145645 | 0.82 | ALDH1A1 (1.00) | ALDH1A1GAARECQLKEAP1CTSL | |
| SCHEMBL5180116 | 0.80 | ALDH1A1 (1.00) | ALDH1A1GAARECQLKEAP1CTSL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2562157-A1 | HETEROARYL (ALKYL) DITHIOCARBAMATE COMPOUNDS, PREPARATION METHODS AND USES THEREOF | Peking University (CN) | 2013-02-27 | — | — | EP | claimed |
| US-20130136794-A1 | HETEROARYL (ALKYL) DITHIOCARBAMATE COMPOUNDS, PREPARATION METHODS AND USES THEREOF | PEKING UNIVERSITY (CN) | 2013-05-30 | — | — | US | disclosed |
| EP-2562157-A1 | HETEROARYL (ALKYL) DITHIOCARBAMATE COMPOUNDS, PREPARATION METHODS AND USES THEREOF | Peking University (CN) | 2013-02-27 | — | — | EP | 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-20130136794-A1 | HETEROARYL (ALKYL) DITHIOCARBAMATE COMPOUNDS, PREPARATION METHODS AND USES THEREOF | LTK, ERBB2, ABL1 | ALDH1A1 2942/4885GAA 1564/4885RECQL 2966/4885 |
“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.