Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.73 |
| ▸ | LMNA | P02545 | 2/20 | 0.73 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CRHBP | P24387 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.50 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Nitrobenzene SCHEMBL3253442 | 0.91 | ALDH1A1 (0.80) | ALDH1A1LMNAL3MBTL1MEN1KMT2A | |
| Nitrobenzene SCHEMBL3335088 | 0.88 | ALDH1A1 (0.76) | ALDH1A1LMNAL3MBTL1MEN1KMT2A | |
| Nitrobenzene SCHEMBL1395189 | 0.88 | ALDH1A1 (0.76) | ALDH1A1LMNAL3MBTL1MEN1KMT2A | |
| Nitrobenzene SCHEMBL3828112 | 0.85 | ALDH1A1 (0.89) | ALDH1A1LMNAL3MBTL1MEN1KMT2A | |
| Nitrobenzene SCHEMBL15525745 | 0.85 | ALDH1A1 (1.00) | ALDH1A1LMNAL3MBTL1MEN1KMT2A | |
| Nitrobenzene SCHEMBL2255264 | 0.85 | ALDH1A1 (1.00) | ALDH1A1LMNAL3MBTL1MEN1KMT2A | |
| Nitrobenzene SCHEMBL2358164 | 0.85 | ALDH1A1 (1.00) | ALDH1A1LMNAL3MBTL1MEN1KMT2A | |
| Nitrobenzene SCHEMBL1330825 | 0.85 | — | — | |
| Nitrobenzene SCHEMBL1330714 | 0.85 | — | — | |
| Nitrobenzene SCHEMBL9669095 | 0.85 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115894909-A | Polyethyleneimine nitrophenyl thiourea probe, preparation method and application thereof in anion recognition | 新疆大学 | 2023-04-04 | — | — | CN | claimed |
| CN-106458878-B | 2- cyano -3- cyclopropyl -3- hydroxy-ns-thio the acrylamide derivative of aryl - | 艾格埃克斯制药有限公司 | 2018-08-31 | — | — | CN | disclosed |
| CN-106458878-A | 2-cyano-3-cyclopropyl-3-hydroxy-n-aryl-thioacrylamide derivatives | 艾格埃克斯制药有限公司 | 2017-02-22 | — | — | CN | disclosed |
| US-20050065118-A1 | Organosulfur inhibitors of tyrosine phosphatases | METABASIS THERAPEUTICS, INC. | 2005-03-24 | — | — | 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-20050065118-A1 | Organosulfur inhibitors of tyrosine phosphatases | PTPRS, PTPRJ, PTPRCAP | ALDH1A1 961/4885LMNA 4884/4885L3MBTL1 279/4885 |
“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.