Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6222648 | 0.76 | CYP2D6 (0.42) | TAAR1CYP2D6CYP2C19POLBKCNH2 | |
| SCHEMBL22903602 | 0.75 | TSHR (0.36) | TAAR1CYP2D6CYP2C19KCNH2ALDH1A1 | |
| SCHEMBL13145782 | 0.73 | TAAR1 (0.48) | TAAR1CYP2D6CYP2C19POLBKCNH2 | |
| SCHEMBL2760196 | 0.66 | CYP2D6 (0.55) | CYP2D6CYP2C19POLBKCNH2KCNA5 | |
| SCHEMBL13180333 | 0.66 | TAAR1 (0.55) | TAAR1CYP2D6CYP2C19POLBKCNH2 | |
| SCHEMBL5779464 | 0.66 | CYP2D6 (0.50) | TAAR1CYP2D6CYP2C19KCNH2ALDH1A1 | |
| SCHEMBL13145809 | 0.66 | CYP2D6 (0.46) | TAAR1CYP2D6CYP2C19POLBKCNH2 | |
| SCHEMBL13145774 | 0.66 | CYP2C19 (0.42) | TAAR1CYP2D6CYP2C19POLBKCNH2 | |
| Hydrochloric Acid SCHEMBL28388436 | 0.65 | CYP2D6 (0.53) | CYP2D6CYP2C19POLBKCNH2KCNA5 | |
| SCHEMBL14720135 | 0.65 | CYP2D6 (0.44) | TAAR1CYP2D6CYP2C19POLBKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7247761-B2 | Method for the production of aryl-aryl coupled compounds | MERCK PATENT GMBH (DE) | 2007-07-24 | — | — | US | disclosed |
| US-20060058524-A1 | Method for the production of aryl-aryl coupled compounds | COVION ORGANIC SEMICONDUCTORS GMBH (DE) | 2006-03-16 | — | — | 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-20060058524-A1 | Method for the production of aryl-aryl coupled compounds | TYR, AHR, ARSA | TAAR1 593/4885CYP2D6 27/4885CYP2C19 52/4885 |
“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.