Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | TSHR | P16473 | 6/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.37 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.37 |
| ▸ | ACLY | P53396 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TTR | P02766 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9742214 | 0.88 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10HPGDCYP3A4 | |
| SCHEMBL12251273 | 0.83 | ALDH1A1 (0.45) | ALDH1A1TSHRHSD17B10HPGDCYP3A4 | |
| SCHEMBL13167790 | 0.74 | RAPGEF4 (0.41) | ALDH1A1TSHRHSD17B10HPGDCYP3A4 | |
| SCHEMBL24425171 | 0.74 | ALDH1A1 (0.36) | ALDH1A1TSHRHSD17B10HPGDCYP3A4 | |
| SCHEMBL11215289 | 0.73 | HSD17B10 (0.43) | ALDH1A1TSHRHSD17B10HPGDCYP3A4 | |
| SCHEMBL10936836 | 0.73 | HSD17B10 (0.50) | ALDH1A1HSD17B10HPGDCYP3A4CA1 | |
| SCHEMBL25008862 | 0.73 | HSD17B10 (0.52) | ALDH1A1TSHRHSD17B10HPGDCYP3A4 | |
| SCHEMBL7779210 | 0.71 | TSHR (0.42) | ALDH1A1TSHRHSD17B10HPGDCYP3A4 | |
| SCHEMBL23542368 | 0.71 | HSD17B10 (0.39) | ALDH1A1TSHRHSD17B10HPGDCYP3A4 | |
| SCHEMBL5848266 | 0.71 | AKR1C2 (0.55) | ALDH1A1TSHRHSD17B10HPGDCYP3A4 |
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-20230026611-A1 | ARYL HETEROCYCLIC COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS | D. E. SHAW RESEARCH, LLC | 2023-01-26 | — | — | 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-20230026611-A1 | ARYL HETEROCYCLIC COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS | KCNA3, KCNH2, KCNJ2 | ALDH1A1 1910/4885TSHR 1706/4885HSD17B10 1230/4885 |
“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.