Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 5/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.40 |
| ▸ | PADI4 | Q9UM07 | 3/20 | 0.40 |
| ▸ | PADI2 | Q9Y2J8 | 2/20 | 0.39 |
| ▸ | KDM1A | O60341 | 5/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.39 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.39 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.38 |
| ▸ | CCKBR | P32239 | 1/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6689563 | 0.87 | FOLH1 (0.45) | CXCR4FOLH1PRSS1PRSS2PRSS3 | |
| SCHEMBL6018195 | 0.84 | CXCR4 (0.46) | CXCR4HDAC3HDAC1HDAC2MCHR1 | |
| SCHEMBL6018843 | 0.83 | CXCR4 (0.51) | CXCR4HDAC1HDAC2FOLH1PRSS1 | |
| SCHEMBL6018099 | 0.83 | CXCR4 (0.46) | CXCR4HDAC3HDAC1HDAC2MCHR1 | |
| SCHEMBL6018284 | 0.81 | HDAC3 (0.47) | CXCR4HDAC3HDAC1HDAC2MCHR1 | |
| SCHEMBL6017948 | 0.80 | HDAC1 (0.45) | CXCR4HDAC3HDAC1HDAC2MCHR1 | |
| SCHEMBL6017964 | 0.80 | CXCR4 (0.43) | CXCR4HDAC3HDAC1HDAC2MCHR1 | |
| SCHEMBL6018133 | 0.78 | CXCR4 (0.43) | CXCR4HDAC3HDAC1HDAC2MCHR1 | |
| SCHEMBL6018294 | 0.78 | CXCR4 (0.41) | CXCR4HDAC3HDAC1HDAC2MCHR1 | |
| SCHEMBL6018022 | 0.78 | CXCR4 (0.41) | CXCR4HDAC3HDAC1HDAC2MCHR1 |
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-7098215-B2 | Nitrogenous compounds and antiviral drugs containing the same | KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) | 2006-08-29 | — | — | US | disclosed |
| US-20040157818-A1 | Cxcr4-antagonistic drugs composed of nitrogen-containing compound | KUREHA CORPORATION (JP) | 2004-08-12 | — | — | US | disclosed |
| US-20040092556-A1 | Nitrogenous compounds and antiviral drugs containing the same | KUREHA CORPORATION (JP) | 2004-05-13 | — | — | US | disclosed |
| EP-1273571-A1 | NITROGENOUS COMPOUNDS AND ANTIVIRAL DRUGS CONTAINING THE SAME | Kureha Chemical Industry Co., Ltd. (JP) | 2003-01-08 | — | — | EP | 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-20040092556-A1 | Nitrogenous compounds and antiviral drugs containing the same | NSUN2, ZC3HAV1L, PNP | CXCR4 2185/4885HDAC3 2307/4885HDAC1 651/4885 |
| US-20040157818-A1 | Cxcr4-antagonistic drugs composed of nitrogen-containing compound | CXCR4, CXCR1, CXCR2 | CXCR4 1/4885HDAC3 1135/4885HDAC1 1092/4885 |
“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.