Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | DAO | P14920 | 4/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5671273 | 0.86 | CYP3A4 (0.76) | CYP3A4ALDH1A1TDP1KDM1AMAPT | |
| SCHEMBL5671269 | 0.86 | CYP3A4 (0.76) | CYP3A4ALDH1A1TDP1KDM1AMAPT | |
| SCHEMBL20148117 | 0.84 | CYP3A4 (0.78) | CYP3A4ALDH1A1TDP1KDM1AMAPT | |
| SCHEMBL18214339 | 0.84 | CYP3A4 (0.78) | CYP3A4ALDH1A1TDP1DAOKDM1A | |
| SCHEMBL18214442 | 0.83 | CYP3A4 (0.76) | CYP3A4ALDH1A1TDP1KDM1AMAPT | |
| SCHEMBL18214373 | 0.83 | CYP3A4 (0.76) | CYP3A4ALDH1A1TDP1KDM1AMAPT | |
| SCHEMBL11308370 | 0.83 | CYP3A4 (0.76) | CYP3A4ALDH1A1TDP1KDM1AMAPT | |
| Dihydrokawain SCHEMBL2743647 | 0.83 | CYP3A4 (1.00) | CYP3A4ALDH1A1TDP1KDM1AMAPT | |
| Dihydrokawain SCHEMBL5672433 | 0.83 | CYP3A4 (1.00) | CYP3A4ALDH1A1TDP1KDM1AMAPT | |
| SCHEMBL18214340 | 0.81 | CYP3A4 (0.72) | CYP3A4ALDH1A1TDP1DAOKDM1A |
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 |
|---|---|---|---|---|---|---|---|
| US-20200255395-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | KUALITY HERBCEUTICS LLC (US) | 2020-08-13 | — | — | US | disclosed |
| US-20180134679-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | KUALITY HERBCEUTICS LLC (US) | 2018-05-17 | — | — | US | disclosed |
| WO-2016179587-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | KUALITY HERBCEUTICS LLC (US) | 2016-11-10 | — | — | 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 (2 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-20180134679-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | NQO1, VHL, XIAP | CYP3A4 2215/4885ALDH1A1 223/4885TDP1 1633/4885 |
| US-20200255395-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | NQO1, VHL, XIAP | CYP3A4 2215/4885ALDH1A1 223/4885TDP1 1633/4885 |
“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.