Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | IMPDH2 | P12268 | 4/20 | 0.45 |
| ▸ | SIRT3 | Q9NTG7 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.44 |
| ▸ | F7 | P08709 | 1/20 | 0.42 |
| ▸ | F3 | P13726 | 1/20 | 0.42 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.42 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.42 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.42 |
| ▸ | CDK8 | P49336 | 2/20 | 0.42 |
| ▸ | CCNC | P24863 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Isoquinoline SCHEMBL28990412 | 0.92 | IMPDH2 (0.47) | KDM4EHTTIMPDH2ROCK2ROCK1 | |
| Isoquinoline SCHEMBL3099710 | 0.92 | KDM4E (0.50) | KDM4EHTTIMPDH2SIRT3TDP1 | |
| Isoquinoline SCHEMBL523706 | 0.90 | IMPDH2 (0.50) | KDM4EHTTIMPDH2ROCK2ROCK1 | |
| Isoquinoline SCHEMBL2230386 | 0.90 | IMPDH2 (0.50) | KDM4EHTTIMPDH2SIRT3TDP1 | |
| Isoquinoline SCHEMBL2227676 | 0.88 | KDM4E (0.47) | KDM4EHTTIMPDH2SIRT3TDP1 | |
| Isoquinoline SCHEMBL7759029 | 0.87 | ROCK2 (0.44) | KDM4EHTTIMPDH2SIRT3TDP1 | |
| Isoquinoline SCHEMBL11346369 | 0.85 | IMPDH2 (0.53) | KDM4EHTTIMPDH2ROCK2ROCK1 | |
| Isoquinoline SCHEMBL6612840 | 0.85 | CYP1A2 (0.48) | KDM4EHTTIMPDH2ROCK2CYP3A4 | |
| Isoquinoline SCHEMBL2311387 | 0.85 | CYP1A2 (0.48) | KDM4EHTTIMPDH2ROCK2CYP3A4 | |
| Isoquinoline SCHEMBL27997841 | 0.85 | KDM4E (0.48) | KDM4EHTTIMPDH2ROCK2CYP3A4 |
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-7183411-B2 | Naphthol, quinoline and isoquinoline-derived urea modulators of vanilloid VR1 receptor | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-02-27 | — | — | US | disclosed |
| US-20040157865-A1 | Naphthol, quinoline and isoquinoline-derived urea modulators of vanilloid VR1 receptor | JANSSEN PHARMACEUTICA, N.V. (BE) | 2004-08-12 | — | — | US | disclosed |
| WO-2004007459-A2 | NAPHTHOL, QUINOLINE AND ISOQUINOLINE-DERIVATIVES AS MODULATORS OF VANILLOID VR1 RECEPTOR | JANSSEN PHARMACEUTICA N.V. (BE) | 2004-01-22 | — | — | WO | 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-20040157865-A1 | Naphthol, quinoline and isoquinoline-derived urea modulators of vanilloid VR1 receptor | OPRL1, VRK1, OPRK1 | KDM4E 4524/4885HTT 2953/4885IMPDH2 1886/4885 |
“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.