Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | F3 | P13726 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | ABL1 | P00519 | 1/20 | 0.48 |
| ▸ | TTR | P02766 | 1/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.48 |
| ▸ | BCR | P11274 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Para-Methoxy Cinnamaldehyde SCHEMBL547945 | 0.92 | ALDH1A1 (0.61) | ALDH1A1CYP2A6KDM4ELMNACYP3A4 | |
| Para-Methoxy Cinnamaldehyde SCHEMBL1046275 | 0.92 | ALDH1A1 (0.61) | ALDH1A1CYP2A6KDM4ELMNACYP3A4 | |
| Para-Methoxy Cinnamaldehyde SCHEMBL514958 | 0.92 | ALDH1A1 (0.61) | ALDH1A1CYP2A6KDM4ELMNACYP3A4 | |
| SCHEMBL27725906 | 0.87 | HDAC8 (0.59) | ALDH1A1CYP2A6KDM4ELMNACYP3A4 | |
| SCHEMBL11876953 | 0.85 | ALDH1A1 (0.57) | ALDH1A1CYP2A6KDM4ELMNACYP3A4 | |
| SCHEMBL566691 | 0.85 | ALDH1A1 (0.57) | ALDH1A1CYP2A6KDM4ELMNACYP3A4 | |
| SCHEMBL11875760 | 0.85 | ALDH1A1 (0.57) | ALDH1A1CYP2A6KDM4ELMNACYP3A4 | |
| SCHEMBL11875764 | 0.85 | ALDH1A1 (0.57) | ALDH1A1CYP2A6KDM4ELMNACYP3A4 | |
| SCHEMBL566692 | 0.85 | ALDH1A1 (0.57) | ALDH1A1CYP2A6KDM4ELMNACYP3A4 | |
| SCHEMBL11876949 | 0.85 | ALDH1A1 (0.57) | ALDH1A1CYP2A6KDM4ELMNACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2459727-A2 | BIOCATALYST FOR CATALYTIC HYDROAMINATION | BASF SE (DE) | 2012-06-06 | — | — | EP | disclosed |
| US-20120123155-A1 | BIOCATALYST FOR CATALYTIC HYDROAMINATION | BASF SE (DE) | 2012-05-17 | — | — | US | disclosed |
| WO-2011012632-A2 | BIOCATALYST FOR CATALYTIC HYDROAMINATION | BASF SE (DE) | 2011-02-03 | — | — | 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-20120123155-A1 | BIOCATALYST FOR CATALYTIC HYDROAMINATION | HDHD5, PAH, GRHPR | ALDH1A1 783/4885CYP2A6 1439/4885KDM4E 2889/4885 |
“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.