Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKAA2 | P54646 | 11/20 | 0.46 |
| ▸ | PRKAB2 | O43741 | 6/20 | 0.46 |
| ▸ | PRKAG1 | P54619 | 6/20 | 0.46 |
| ▸ | PRKAA1 | Q13131 | 6/20 | 0.46 |
| ▸ | PRKAG3 | Q9UGI9 | 6/20 | 0.46 |
| ▸ | PRKAG2 | Q9UGJ0 | 6/20 | 0.46 |
| ▸ | PRKAB1 | Q9Y478 | 6/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.42 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL348092 | 0.93 | PRKAA2 (0.43) | PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3 | |
| SCHEMBL10077357 | 0.92 | KMT2A (0.41) | PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3 | |
| SCHEMBL347914 | 0.90 | EPHX2 (0.48) | KMT2AHRH3EPHX2NPC1RAB9A | |
| SCHEMBL1839277 | 0.88 | KMT2A (0.45) | KMT2AEPHX2NPC1RAB9AEPHX1 | |
| Trifluoroacetic Acid SCHEMBL347844 | 0.88 | EPHX2 (0.44) | PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3 | |
| Trifluoroacetic Acid SCHEMBL346884 | 0.87 | EPHX2 (0.41) | PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3 | |
| SCHEMBL347845 | 0.86 | EPHX2 (0.46) | PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3 | |
| Trifluoroacetic Acid SCHEMBL15310321 | 0.85 | EPHX2 (0.40) | KMT2AHRH3EPHX2 | |
| SCHEMBL348445 | 0.76 | KMT2A (0.43) | PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3 | |
| SCHEMBL1020858 | 0.74 | EPHX1 (0.56) | KMT2AEPHX2NPC1RAB9AEPHX1 |
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-8759352-B2 | 1-(4-ureidobenzoyl)piperazine derivatives | MERCK SHARP & DOHME B.V. (NL) | 2014-06-24 | — | — | US | disclosed |
| EP-2318368-B1 | 1-(4-UREIDOBENZOYL)PIPERAZINE DERIVATIVES | MERCK SHARP & DOHME (NL) | 2013-10-16 | — | — | EP | disclosed |
| US-20120015958-A1 | 1-(4-UREIDOBENZOYL)PIPERAZINE DERIVATIVES | N.V. ORGANON (NL) | 2012-01-19 | — | — | 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-20120015958-A1 | 1-(4-UREIDOBENZOYL)PIPERAZINE DERIVATIVES | NPC1, ABCB11, NPC1L1 | PRKAA2 4031/4885PRKAB2 4576/4885PRKAG1 4577/4885 |
“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.