Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL30309824 | 1.00 | ALDH1A1 (0.34) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL25839577 | 0.91 | ALDH1A1 (0.35) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL25118141 | 0.90 | ALDH1A1 (0.33) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL25839766 | 0.90 | ALDH1A1 (0.33) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL25839690 | 0.90 | JAK2 (0.35) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL25416742 | 0.89 | ALDH1A1 (0.34) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL25839656 | 0.89 | ALDH1A1 (0.33) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL25171195 | 0.89 | JAK3 (0.33) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL25839652 | 0.88 | ALDH1A1 (0.31) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 | |
| SCHEMBL25118112 | 0.84 | ALDH1A1 (0.39) | ALDH1A1HPGDKDM4EHSD17B10L3MBTL1 |
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 4689/4885HPGD 4855/4885KDM4E 1626/4885 |
“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.