Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CASP2 | P42575 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | FAAH | O00519 | 3/20 | 0.36 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13225553 | 0.91 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2RAB9AL3MBTL1NPC1 | |
| SCHEMBL1101631 | 0.89 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2RAB9AL3MBTL1NPC1 | |
| SCHEMBL3548845 | 0.87 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2RAB9AL3MBTL1NPC1 | |
| SCHEMBL13469003 | 0.86 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2RAB9AHPGDKMT2A | |
| SCHEMBL22268862 | 0.85 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2RAB9AL3MBTL1NPC1 | |
| SCHEMBL12107776 | 0.85 | ALDH1A1 (0.52) | ALDH1A1HPGDCASP2NAAAFAAH | |
| SCHEMBL19125639 | 0.83 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2RAB9AL3MBTL1NPC1 | |
| SCHEMBL13407579 | 0.83 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2RAB9AL3MBTL1NPC1 | |
| SCHEMBL7649871 | 0.83 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2RAB9AL3MBTL1NPC1 | |
| SCHEMBL226350 | 0.83 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8092833-B2 | Compositions containing inclusion complexes | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2012-01-10 | — | — | US | disclosed |
| US-20110182864-A1 | COMPOSITIONS CONTAINING INCLUSION COMPLEXES | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2011-07-28 | — | — | 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-20110182864-A1 | COMPOSITIONS CONTAINING INCLUSION COMPLEXES | EXOSC5, EXOSC9, INTS6 | ALDH1A1 2996/4885SMN1; SMN2 309/4885RAB9A 4206/4885 |
“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.