Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | METAP1 | P53582 | 1/20 | 0.57 |
| ▸ | TDP2 | O95551 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | S100A4 | P26447 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | BCL2 | P10415 | 2/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.40 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.40 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | CMA1 | P23946 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13716800 | 1.00 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2C19METAP1TDP2 | |
| SCHEMBL3972232 | 1.00 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2C19METAP1TDP2 | |
| SCHEMBL13717080 | 0.90 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2C19METAP1TDP2 | |
| SCHEMBL3965519 | 0.90 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2C19METAP1TDP2 | |
| SCHEMBL3965520 | 0.90 | ALDH1A1 (0.59) | ALDH1A1CYP1A2CYP2C19METAP1TDP2 | |
| SCHEMBL10144900 | 0.82 | METAP1 (0.45) | ALDH1A1CYP1A2CYP2C19METAP1TDP2 | |
| SCHEMBL571311 | 0.82 | METAP1 (0.45) | ALDH1A1CYP1A2CYP2C19METAP1TDP2 | |
| SCHEMBL10182356 | 0.82 | METAP1 (0.45) | ALDH1A1CYP1A2CYP2C19METAP1TDP2 | |
| SCHEMBL571312 | 0.82 | METAP1 (0.45) | ALDH1A1CYP1A2CYP2C19METAP1TDP2 | |
| SCHEMBL10182213 | 0.81 | METAP1 (0.44) | ALDH1A1CYP1A2CYP2C19METAP1TDP2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115572262-B | Isoquinoline derivative and preparation method thereof | 厦门沃克沃德医药科技有限公司 | 2024-08-27 | — | — | CN | disclosed |
| CN-115572262-A | Isoquinoline derivative and preparation method thereof | 厦门沃克沃德医药科技有限公司 | 2023-01-06 | — | — | CN | disclosed |
| CN-110818698-A | A-pi-D-pi-A type organic small molecule based on diindenopyrazine and preparation method and application thereof | 湘潭大学 | 2020-02-21 | — | — | CN | disclosed |
| WO-2014089324-A1 | SUBSTITUTED CYCLIC COMPOUNDS AND METHODS OF USE | CALITOR SCIENCES, LLC (US) | 2014-06-12 | — | — | WO | disclosed |
| US-7572809-B2 | Isoquinoline aminopyrazole derivatives | HOFFMANN-LA ROCHE INC. (US) | 2009-08-11 | — | — | US | disclosed |
| EP-1966190-A1 | ISOQUINOLINE AMINOPYRAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS FOR THE TREATMENT OF CANCER | F.HOFFMANN-LA ROCHE AG (CH) | 2008-09-10 | — | — | EP | disclosed |
| US-20070179151-A1 | Isoquinoline aminopyrazole derivatives | F. HOFMANN-LA ROCHE AG (CH) | 2007-08-02 | — | — | US | disclosed |
| WO-2007071348-A1 | ISOQUINOLINE AMINOPYRAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS FOR THE TREATMENT OF CANCER | F. HOFFMANN-LA ROCHE AG (CH) | 2007-06-28 | — | — | WO | 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-20070179151-A1 | Isoquinoline aminopyrazole derivatives | CYP3A5, CYP3A43, CYP3A4 | ALDH1A1 198/4885CYP1A2 9/4885CYP2C19 17/4885 |
“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.