Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CETP | P11597 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | PTGIR | P43119 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5353509 | 0.81 | NR1H2 (0.38) | NR1H2NR1H3SLC6A2SLC6A4KDM4E | |
| SCHEMBL5355490 | 0.80 | SLC6A2 (0.44) | NR1H2NR1H3SLC6A2SLC6A4MEN1 | |
| SCHEMBL1459826 | 0.71 | HSD11B1 (0.55) | NR1H2NR1H3SLC6A2SLC6A4CYP2D6 | |
| SCHEMBL1461003 | 0.70 | SLC6A2 (0.41) | SLC6A2SLC6A4MEN1KMT2ACYP2D6 | |
| SCHEMBL1460721 | 0.70 | ESR2 (0.51) | NR1H2NR1H3HSD11B1 | |
| SCHEMBL1461945 | 0.69 | GRIN2B (0.48) | NR1H2NR1H3SLC6A2SLC6A4KDM4E | |
| SCHEMBL1460726 | 0.68 | HSD11B1 (0.39) | SLC6A2SLC6A4CYP2D6HSD11B1PTGIR | |
| SCHEMBL1460723 | 0.67 | DRD2 (0.47) | NR1H2NR1H3SLC6A2SLC6A4MEN1 | |
| SCHEMBL1459859 | 0.67 | PTGDR2 (0.44) | SLC6A2SLC6A4MEN1KMT2AHSD11B1 | |
| SCHEMBL1198328 | 0.66 | KDM4E (0.46) | KDM4EAOC3MEN1KMT2ACYP1A2 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101087754-B | Cyclohexane derivatives | HOFFMANN LA ROCHE | 2012-01-18 | — | — | CN | claimed |
| CN-101087754-A | Novel cyclohexane derivatives | HOFFMANN LA ROCHE (CH) | 2007-12-12 | — | — | CN | claimed |
| US-7253282-B2 | Hexafluoroisopropanol substituted cyclohexane derivatives | HOFFMAN-LA ROCHE INC. (US) | 2007-08-07 | — | — | US | claimed |
| US-20060135601-A1 | Novel hexafluoroisopropanol substituted cyclohexane derivatives | HOFFMANN-LA ROCHE INC. | 2006-06-22 | — | — | US | claimed |
| CN-101087754-B | Cyclohexane derivatives | HOFFMANN LA ROCHE | 2012-01-18 | — | — | CN | disclosed |
| CN-101087754-A | Novel cyclohexane derivatives | HOFFMANN LA ROCHE (CH) | 2007-12-12 | — | — | CN | disclosed |
| EP-1831158-A1 | NOVEL CYCLOHEXANE DERIVATIVES | F. Hoffmann-Roche AG (CH) | 2007-09-12 | — | — | EP | disclosed |
| US-7253282-B2 | Hexafluoroisopropanol substituted cyclohexane derivatives | HOFFMAN-LA ROCHE INC. (US) | 2007-08-07 | — | — | US | disclosed |
| WO-2006066779-A1 | NOVEL CYCLOHEXANE DERIVATIVES | F.HOFFMANN-LA ROCHE AG (CH) | 2006-06-29 | — | — | WO | disclosed |
| US-20060135601-A1 | Novel hexafluoroisopropanol substituted cyclohexane derivatives | HOFFMANN-LA ROCHE INC. | 2006-06-22 | — | — | 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-20060135601-A1 | Novel hexafluoroisopropanol substituted cyclohexane derivatives | NR1H3, NR1H2, NR1I2 | NR1H2 2/4885NR1H3 1/4885SLC6A2 3185/4885 |
“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.