Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL6311776 | 0.79 | CYP1A1 (0.47) | ALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL21425786 | 0.78 | ALDH1A1 (0.50) | ALDH1A1HDAC8TSHRCHRNB2CHRNB4 | |
| SCHEMBL4456617 | 0.76 | ALDH1A1 (0.48) | ALDH1A1HDAC8TSHRCHRNB2CHRNB4 | |
| SCHEMBL7835694 | 0.75 | ESR1 (0.46) | ALDH1A1KDM4ETSHRNPC1PKM | |
| SCHEMBL6312464 | 0.73 | KDM4E (0.34) | ALDH1A1KDM4ETSHRNPC1PKM | |
| SCHEMBL27510932 | 0.71 | ALDH1A1 (0.46) | ALDH1A1HDAC8TSHR | |
| SCHEMBL22722384 | 0.70 | ALDH1A1 (0.50) | ALDH1A1KDM4EHDAC8TSHRCHRNB2 | |
| SCHEMBL6823274 | 0.68 | PLK1 (0.37) | ALDH1A1KDM4E | |
| Water SCHEMBL20378930 | 0.67 | ALDH1A1 (0.92) | ALDH1A1KDM4EHDAC8TSHRPKM | |
| Water SCHEMBL28759143 | 0.67 | ALDH1A1 (0.92) | ALDH1A1KDM4EHDAC8TSHRPKM |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1306369-B1 | NOVEL SULFUR COMPOUNDS AND INTERMOLECULAR COMPOUNDS CONTAINING THE SAME AS THE COMPONENT COMPOUND | NIPPON SODA CO (JP) | 2008-11-05 | — | — | EP | disclosed |
| US-6927309-B2 | Sulfur compounds and intermolecular compounds containing the same as the component compounds | NIPPON SODA CO., LTD. (JP) | 2005-08-09 | — | — | US | disclosed |
| US-20040176643-A1 | Novel sulfur compounds and intermolecular compounds containing the same as the component compounds | NIPPON SODA CO., LTD. (JP) | 2004-09-09 | — | — | US | disclosed |
| EP-1306369-A1 | NOVEL SULFUR COMPOUNDS AND INTERMOLECULAR COMPOUNDS CONTAINING THE SAME AS THE COMPONENT COMPOUND | NIPPON SODA CO., LTD. (JP) | 2003-05-02 | — | — | EP | 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-20040176643-A1 | Novel sulfur compounds and intermolecular compounds containing the same as the component compounds | CBS, TST, ABCB7 | ALDH1A1 1370/4885KDM4E 3952/4885HDAC8 3345/4885 |
“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.