Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.62 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.38 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5235492 | 0.93 | CYP2A6 (0.67) | CYP2A6CA1CA2IDO1CHRNA7 | |
| SCHEMBL31547776 | 0.85 | CYP2A6 (0.71) | CYP2A6CA1CA2IDO1CHRNA7 | |
| SCHEMBL277679 | 0.85 | CYP2A6 (0.71) | CYP2A6CA1CA2IDO1CHRNA7 | |
| Hydrochloric Acid SCHEMBL2967756 | 0.84 | CYP2A6 (0.69) | CYP2A6CA1CA2IDO1CHRNA7 | |
| SCHEMBL9347729 | 0.83 | CYP2A6 (0.55) | CYP2A6CA1CA2IDO1CHRNA7 | |
| SCHEMBL9347766 | 0.83 | CYP2A6 (0.55) | CYP2A6CA1CA2IDO1CHRNA7 | |
| SCHEMBL5536097 | 0.83 | CYP2A6 (0.55) | CYP2A6CA1CA2IDO1CHRNA7 | |
| SCHEMBL7434783 | 0.81 | CYP2A6 (0.67) | CYP2A6CA1CA2IDO1CHRNA7 | |
| SCHEMBL5540612 | 0.81 | CYP2A6 (0.56) | CYP2A6CA1CA2IDO1CHRNA7 | |
| SCHEMBL368354 | 0.81 | CYP2A6 (0.56) | CYP2A6CA1CA2IDO1CHRNA7 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10367143-B2 | Organic semiconducting compounds | MERCK PATENT GMBH (DE) | 2019-07-30 | — | — | US | disclosed |
| US-20170084839-A1 | ORGANIC SEMICONDUCTING COMPOUNDS | MERCK PATENT GMBH (DE) | 2017-03-23 | — | — | US | disclosed |
| EP-3119776-A1 | ORGANIC SEMICONDUCTING COMPOUNDS | Merck Patent GmbH (DE) | 2017-01-25 | — | — | EP | disclosed |
| WO-2015139802-A1 | ORGANIC SEMICONDUCTING COMPOUNDS | MERCK PATENT GMBH (DE) | 2015-09-24 | — | — | 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-20170084839-A1 | ORGANIC SEMICONDUCTING COMPOUNDS | PPOX, OSTC, OCIAD1 | CYP2A6 3046/4885CA1 4063/4885CA2 3708/4885 |
| US-10367143-B2 | Organic semiconducting compounds | PPOX, OSTC, OCIAD1 | CYP2A6 3046/4885CA1 4063/4885CA2 3708/4885 |
“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.