Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.86 |
| ▸ | ATM | Q13315 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 5/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | NAAA | Q02083 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| Acetic Acid Butyl Ester SCHEMBL27651035 | 0.98 | ALDH1A1 (0.82) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| Acetic Acid Butyl Ester SCHEMBL27719488 | 0.94 | ALDH1A1 (0.75) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| Acetic Acid Butyl Ester SCHEMBL14969 | 0.93 | — | — | |
| Acetic Acid Butyl Ester SCHEMBL8026335 | 0.93 | ALDH1A1 (1.00) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| Acetic Acid Butyl Ester SCHEMBL28984633 | 0.93 | ALDH1A1 (1.00) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| Acetic Acid Butyl Ester SCHEMBL1350194 | 0.93 | — | — | |
| Acetic Acid Butyl Ester SCHEMBL28960923 | 0.93 | ALDH1A1 (1.00) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| Acetic Acid Butyl Ester SCHEMBL27668859 | 0.92 | ALDH1A1 (0.72) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| Acetic Acid Butyl Ester SCHEMBL11882617 | 0.91 | ALDH1A1 (0.78) | ALDH1A1ATMTSHRHPGDHCAR2 | |
| Acetic Acid Butyl Ester SCHEMBL25225804 | 0.90 | — | — |
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-109232292-A | A kind of preparation method of 2,6- diethyl -4- aminomethyl phenyl malonamide | 浙江中山化工集团股份有限公司 | 2019-01-18 | — | — | CN | disclosed |
| US-9365525-B2 | System and method for extraction of chemicals from lignocellulosic materials | AMERICAN SCIENCE AND TECHNOLOGY CORPORATION (US) | 2016-06-14 | — | — | US | disclosed |
| US-20140227161-A1 | SYSTEM AND METHOD FOR EXTRACTION OF CHEMICALS FROM LIGNOCELLULOSIC MATERIALS | AMERICAN SCIENCE AND TECHNOLOGY CORPORATION (US) | 2014-08-14 | — | — | US | disclosed |
| CN-101720329-A | Alkylphosphinic acids, salts and esters, method for the production thereof and use thereof | CLARIANT INT LTD | 2010-06-02 | — | — | CN | 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-20140227161-A1 | SYSTEM AND METHOD FOR EXTRACTION OF CHEMICALS FROM LIGNOCELLULOSIC MATERIALS | DCXR, SORD, LCT | ALDH1A1 738/4885ATM 1720/4885TSHR 4733/4885 |
“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.