Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.36 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | AQP3 | Q92482 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | VDR | P11473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4411763 | 1.00 | CYP3A4 (0.57) | CYP3A4CYP2C19CYP2D6CYP1A2MAPT | |
| SCHEMBL3391969 | 1.00 | CYP3A4 (0.57) | CYP3A4CYP2C19CYP2D6CYP1A2MAPT | |
| SCHEMBL10409067 | 0.91 | CYP2D6 (0.56) | CYP3A4CYP2C19CYP2D6CYP1A2GAA | |
| SCHEMBL10376015 | 0.88 | CYP2D6 (0.67) | CYP3A4CYP2C19CYP2D6CYP1A2GAA | |
| SCHEMBL657896 | 0.88 | CYP2D6 (0.67) | CYP3A4CYP2C19CYP2D6CYP1A2GAA | |
| SCHEMBL21024445 | 0.87 | CYP2D6 (0.52) | CYP3A4CYP2C19CYP2D6CYP1A2GAA | |
| SCHEMBL31466151 | 0.86 | CYP2D6 (0.55) | CYP3A4CYP2C19CYP2D6CYP1A2GAA | |
| SCHEMBL9100877 | 0.86 | CYP3A4 (0.52) | CYP3A4CYP2C19CYP2D6MAPTGAA | |
| SCHEMBL8705300 | 0.85 | CYP2D6 (0.51) | CYP3A4CYP2C19CYP2D6CYP1A2MAPT | |
| SCHEMBL8705296 | 0.85 | CYP2D6 (0.51) | CYP3A4CYP2C19CYP2D6CYP1A2MAPT |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090281332-A1 | PROCESS FOR PRODUCING ESTER OR ALCOHOL | MITSUI CHEMICALS, INC. (JP) | 2009-11-12 | — | — | US | disclosed |
| US-20090281332-A1 | PROCESS FOR PRODUCING ESTER OR ALCOHOL | MITSUI CHEMICALS, INC. (JP) | 2009-11-12 | — | — | US | disclosed |
| US-20090281332-A1 | PROCESS FOR PRODUCING ESTER OR ALCOHOL | MITSUI CHEMICALS, INC. (JP) | 2009-11-12 | — | — | US | disclosed |
| EP-2039680-A1 | PROCESS FOR PRODUCING ESTER OR ALCOHOL | Mitsui Chemicals, Inc. (JP) | 2009-03-25 | — | — | EP | disclosed |
| US-5877322-A | Substituted pyridines, their preparation, and their use as pesticides and fungicides | HOECHST SCHERING AGREVO GMBH (DE) | 1999-03-02 | — | — | US | disclosed |
| EP-0719257-A1 | SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES | Hoechst Schering AgrEvo GmbH (DE) | 1996-07-03 | — | — | EP | disclosed |
| WO-1995007892-A1 | SUBSTITUTED PYRIDINES, PROCESS FOR PRODUCING THEM AND THEIR USE AS PESTICIDES AND FUNGICIDES | HOECHST SCHERING AGREVO GMBH (DE) | 1995-03-23 | — | — | 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-20090281332-A1 | PROCESS FOR PRODUCING ESTER OR ALCOHOL | ADH5, ADH1A, ADH1C | CYP3A4 22/4885CYP2C19 94/4885CYP2D6 149/4885 |
“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.