Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | COMT | P21964 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | CDK8 | P49336 | 1/20 | 0.43 |
| ▸ | NEK2 | P51955 | 1/20 | 0.43 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5422878 | 0.87 | CYP2A6 (0.48) | CYP2A6LMNATSHRPIK3CAMEN1 | |
| SCHEMBL29277538 | 0.84 | HTR1A (0.52) | CYP2A6LMNAHTTMEN1KMT2A | |
| SCHEMBL29277541 | 0.84 | KMT2A (0.55) | COMTCYP2A6HSD17B10LMNATSHR | |
| SCHEMBL29277545 | 0.84 | HTT (0.47) | CYP2A6HSD17B10LMNAHTTPIK3CA | |
| SCHEMBL29277533 | 0.83 | CYP2A6 (0.55) | CYP2A6HSD17B10LMNATSHRKMT2A | |
| SCHEMBL8353263 | 0.80 | PTGS2 (0.41) | COMTCYP2A6HSD17B10LMNAMEN1 | |
| SCHEMBL14488472 | 0.77 | PIK3CA (0.43) | COMTCHEK1CDK8NEK2LIMK1 | |
| SCHEMBL29277551 | 0.75 | NFE2L2 (0.47) | NFE2L2MEN1KMT2AHTR6HTR2A | |
| SCHEMBL29277548 | 0.75 | CYP2A6 (0.47) | CYP2A6MEN1KMT2AALDH1A1RAB9A | |
| SCHEMBL329993 | 0.74 | CYP2A6 (0.53) | CYP2A6HSD17B10LMNATSHRKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-117304106-A | Isoquinoline sulfone compound and preparation method and application thereof | 江西师范大学 | 2023-12-29 | — | — | CN | disclosed |
| US-20230025531-A1 | Novel Isoquinoline Derivative, Preparing Method Thereof, and Pharmaceutical Composition for Preventing or Treating Autophagy Related Diseases Containing the Same as an Active Ingredient | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2023-01-26 | — | — | 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-20230025531-A1 | Novel Isoquinoline Derivative, Preparing Method Thereof, and Pharmaceutical Composition for Preventing or Treating Autophagy Related Diseases Containing the Same as an Active Ingredient | ATG7, TFEB, BECN1 | COMT 395/4885CYP2A6 1244/4885CHEK1 2331/4885 |
“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.