Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 15/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CTSL | P07711 | 7/20 | 0.47 |
| ▸ | CTSS | P25774 | 6/20 | 0.47 |
| ▸ | MMP3 | P08254 | 1/20 | 0.46 |
| ▸ | CTSB | P07858 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4868827 | 0.92 | CTSK (0.53) | CTSKALDH1A1CTSLCTSSCTSB | |
| SCHEMBL4871768 | 0.88 | CTSK (0.49) | CTSKALDH1A1CTSLCTSSCTSB | |
| SCHEMBL4865108 | 0.87 | CTSK (0.49) | CTSKALDH1A1CTSLCTSSMMP3 | |
| SCHEMBL4868645 | 0.87 | CTSK (0.49) | CTSKALDH1A1CTSLCTSSCTSB | |
| SCHEMBL4863202 | 0.87 | CTSK (0.49) | CTSKALDH1A1CTSLCTSSCTSB | |
| SCHEMBL4872200 | 0.87 | CTSK (0.48) | CTSKALDH1A1CTSLCTSSMMP3 | |
| SCHEMBL4864014 | 0.87 | CTSK (0.48) | CTSKALDH1A1CTSLCTSSCTSB | |
| SCHEMBL4867979 | 0.87 | CTSK (0.48) | CTSKALDH1A1CTSLCTSSCTSB | |
| SCHEMBL4871726 | 0.87 | CTSK (0.53) | CTSKALDH1A1CTSLCTSSCTSB | |
| SCHEMBL4871673 | 0.83 | CTSK (0.49) | CTSKALDH1A1CTSLCTSSCTSB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7439394-B2 | Cyclohexyl-1,4-diamine compounds | GRUENENTHAL GMBH (DE) | 2008-10-21 | — | — | US | claimed |
| US-20070117803-A1 | Cyclohexyl-1,4-diamine compounds | GRUENENTHAL GMBH (DE) | 2007-05-24 | — | — | US | claimed |
| US-7439394-B2 | Cyclohexyl-1,4-diamine compounds | GRUENENTHAL GMBH (DE) | 2008-10-21 | — | — | US | disclosed |
| US-20070117803-A1 | Cyclohexyl-1,4-diamine compounds | GRUENENTHAL GMBH (DE) | 2007-05-24 | — | — | 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-20070117803-A1 | Cyclohexyl-1,4-diamine compounds | PKD1, DDC, DPYD | CTSK 1123/4885ALDH1A1 158/4885CTSL 2008/4885 |
“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.