Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 15/20 | 0.61 |
| ▸ | TSHR | P16473 | 5/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 8/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13167762 | 0.96 | CYP3A4 (0.59) | CYP3A4TSHRCYP2C9CYP2D6CYP2C19 | |
| SCHEMBL13168037 | 0.94 | CYP2C9 (0.59) | CYP3A4TSHRCYP2C9CYP2D6CYP2C19 | |
| SCHEMBL11955030 | 0.93 | CYP2C19 (0.53) | CYP3A4TSHRCYP2C9CYP2D6CYP2C19 | |
| SCHEMBL11955830 | 0.93 | CYP3A4 (0.54) | CYP3A4TSHRCYP2C9CYP2D6CYP2C19 | |
| SCHEMBL11955029 | 0.87 | CYP2C19 (0.64) | CYP3A4TSHRCYP2C9CYP2D6CYP2C19 | |
| SCHEMBL13168231 | 0.87 | CYP2C9 (0.54) | CYP3A4TSHRCYP2C9CYP2D6CYP2C19 | |
| SCHEMBL14996527 | 0.86 | CYP2C9 (0.54) | CYP3A4TSHRCYP2C9CYP2D6CYP2C19 | |
| SCHEMBL12944876 | 0.85 | CYP2C9 (0.52) | CYP3A4TSHRCYP2C9CYP2D6CYP2C19 | |
| SCHEMBL13168034 | 0.85 | ITGB3 (0.54) | CYP3A4TSHRCYP2C9CYP2D6CYP2C19 | |
| SCHEMBL14996494 | 0.81 | CYP3A4 (0.65) | CYP3A4TSHRCYP2C9CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-8232288-B2 | Substituted benzimidazoles, benzothiazoles and benzoxazoles | GRUENENTHAL GMBH (DE) | 2012-07-31 | — | — | US | disclosed |
| US-20110009382-A1 | Substituted Benzimidazoles, Benzothiazoles and Benzoxazoles | GRUENENTHAL GMBH (DE) | 2011-01-13 | — | — | US | disclosed |
| US-20100249095-A1 | Substituted Spiro-amide Compounds | GRUENENTHAL GMBH (DE) | 2010-09-30 | — | — | 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 (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-20110009382-A1 | Substituted Benzimidazoles, Benzothiazoles and Benzoxazoles | BDKRB1, BDKRB2, BRD1 | CYP3A4 253/4885TSHR 1370/4885CYP2C9 362/4885 |
| US-20100249095-A1 | Substituted Spiro-amide Compounds | BDKRB1, BDKRB2, REN | CYP3A4 3781/4885TSHR 338/4885CYP2C9 2259/4885 |
“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.