Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.31 |
| ▸ | CDK2 | P24941 | 2/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.30 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.30 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25839577 | 0.94 | ALDH1A1 (0.35) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25839652 | 0.94 | ALDH1A1 (0.31) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25416742 | 0.92 | ALDH1A1 (0.34) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25171195 | 0.91 | JAK3 (0.33) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25839563 | 0.89 | ALDH1A1 (0.34) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL30309824 | 0.89 | ALDH1A1 (0.34) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25839761 | 0.84 | ALDH1A1 (0.35) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25118110 | 0.84 | ALDH1A1 (0.35) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25118106 | 0.84 | JAK2 (0.32) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 | |
| SCHEMBL25174091 | 0.83 | ALDH1A1 (0.32) | ALDH1A1KDM4EL3MBTL1HPGDHSD17B10 |
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-20230219978-A1 | COMPOUND HAVING MACROCYCLIC STRUCTURE AND USE THEREOF | SCINNOHUB PHARMACEUTICAL CO., LTD (CN) | 2023-07-13 | — | — | 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-20230219978-A1 | COMPOUND HAVING MACROCYCLIC STRUCTURE AND USE THEREOF | BTK, SRC, YES1 | ALDH1A1 4689/4885KDM4E 1626/4885L3MBTL1 944/4885 |
“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.