Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 4/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.36 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.36 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | KDR | P35968 | 2/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.34 |
| ▸ | PLK4 | O00444 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.34 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.34 |
| ▸ | PRKCG | P05129 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | ROS1 | P08922 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4905587 | 0.81 | ROCK1 (0.48) | IP6K1NAMPTKDRROCK2PLK4 | |
| SCHEMBL4897729 | 0.80 | TNNI3K (0.33) | IP6K1ADAMTS5KDRCDK1CDK2 | |
| SCHEMBL4904991 | 0.79 | ROCK2 (0.39) | IP6K1NAMPTKDRROCK2PLK4 | |
| SCHEMBL4925081 | 0.75 | KDM1A (0.42) | HSD17B1HSD17B2ADAMTS5CXCR2 | |
| SCHEMBL4598811 | 0.75 | MAPKAPK2 (0.61) | ROCK2CHEK2MAPK1GSK3BPRKX | |
| SCHEMBL4596962 | 0.75 | MAPKAPK2 (0.61) | ROCK2CHEK2MAPK1GSK3BPRKX | |
| SCHEMBL4598611 | 0.74 | ROCK1 (0.42) | IP6K1NAMPTKDRROCK2PLK4 | |
| SCHEMBL4599129 | 0.72 | MAPKAPK2 (0.45) | MAPK1ROCK1AURKBQPCTCXCR2 | |
| SCHEMBL4596911 | 0.72 | NAMPT (0.47) | IP6K1NAMPTKDRROCK2PLK4 | |
| SCHEMBL4898767 | 0.72 | RPS6KB1 (0.40) | IP6K1NAMPTKDRROCK2PLK4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080234266-A1 | Squaric Acid Derivatives II | MERCK PATENT GESELLSCHAFT (DE) | 2008-09-25 | — | — | US | claimed |
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-20080234266-A1 | Squaric Acid Derivatives II | CHEK2, CHEK1, SGK3 | HSD17B1 1561/4885HSD17B2 1711/4885IP6K1 121/4885 |
“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.