Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.67 |
| ▸ | ALOX15B | O15296 | 3/20 | 0.67 |
| ▸ | GAA | P10253 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9431436 | 0.86 | POLB (0.56) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL24944906 | 0.81 | CYP1A2 (1.00) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| Hydrochloric Acid SCHEMBL11376841 | 0.81 | CYP1A2 (0.57) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL10424919 | 0.79 | TSHR (0.71) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL10399742 | 0.78 | TSHR (0.55) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| Hydrochloric Acid SCHEMBL11385536 | 0.78 | CYP1A2 (0.55) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL24945027 | 0.77 | CYP1A2 (0.78) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL24944905 | 0.77 | CYP3A4 (1.00) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL24943934 | 0.77 | L3MBTL1 (0.77) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| Hydrochloric Acid SCHEMBL11387397 | 0.76 | NR4A1 (0.57) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 |
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-6730796-B2 | REACTING ISOTHIOCYANATE WITH -AMINOCARBONYL COMPOUND AND ALKYL HALIDE OR ACTIVATED ARYL HALIDE; CYCLIZATION | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2004-05-04 | — | — | US | disclosed |
| US-20040039210-A1 | PROCESS FOR PREPARATION OF N-SUBSTITUTED 2-SULFANYLIMIDAZOLES | CHENG JIE FEI (US) | 2004-02-26 | — | — | 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-20040039210-A1 | PROCESS FOR PREPARATION OF N-SUBSTITUTED 2-SULFANYLIMIDAZOLES | TST, STS, AADAC | CYP1A2 1264/4885CYP3A4 497/4885CYP2C9 1271/4885 |
“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.