Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.51 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL25724298 | 0.86 | CYP2C9 (0.62) | CYP2C9L3MBTL1ALDH1A1TSHRTAS1R3 | |
| SCHEMBL28046500 | 0.85 | CYP2C9 (0.57) | CYP2C9L3MBTL1ALDH1A1TSHRTAS1R3 | |
| SCHEMBL28046501 | 0.85 | CYP2C9 (0.57) | CYP2C9L3MBTL1ALDH1A1TSHRTAS1R3 | |
| SCHEMBL7749748 | 0.85 | CYP2C9 (0.57) | CYP2C9L3MBTL1ALDH1A1TSHRTAS1R3 | |
| SCHEMBL7749751 | 0.85 | CYP2C9 (0.57) | CYP2C9L3MBTL1ALDH1A1TSHRTAS1R3 | |
| SCHEMBL14439338 | 0.84 | CTSS (0.48) | CYP2C9L3MBTL1ALDH1A1TSHRTAS1R3 | |
| SCHEMBL13198957 | 0.84 | ALDH1A1 (0.57) | CYP2C9L3MBTL1ALDH1A1TSHRTAS1R3 | |
| Hydrochloric Acid SCHEMBL8368672 | 0.83 | CYP2C9 (0.56) | CYP2C9L3MBTL1ALDH1A1TSHRTAS1R3 | |
| Hydrochloric Acid SCHEMBL8368674 | 0.83 | CYP2C9 (0.56) | CYP2C9L3MBTL1ALDH1A1TSHRTAS1R3 | |
| SCHEMBL111170 | 0.82 | ALDH1A1 (0.56) | CYP2C9L3MBTL1ALDH1A1TSHRTAS1R3 |
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-9243028-B2 | Facile amide formation via S-nitroso thioacid intermediates | WASHINGTON STATE UNIVERSITY (US) | 2016-01-26 | — | — | US | disclosed |
| US-20120190820-A1 | FACILE AMIDE FORMATION VIA S-NITROSO THIOACID INTERMEDIATES | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2012-07-26 | — | — | 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-20120190820-A1 | FACILE AMIDE FORMATION VIA S-NITROSO THIOACID INTERMEDIATES | NAAA, TST, ASNS | CYP2C9 1468/4885L3MBTL1 2874/4885ALDH1A1 3056/4885 |
“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.