Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 6/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.38 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.38 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.38 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.35 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14998069 | 0.85 | KIF11 (0.56) | KIF11ALDH1A1TSHRCES2CES1 | |
| SCHEMBL16747679 | 0.85 | KIF11 (0.56) | KIF11ALDH1A1TSHRCES2CES1 | |
| SCHEMBL7699654 | 0.80 | KIF11 (0.52) | KIF11ALDH1A1TSHRCES2CES1 | |
| SCHEMBL8617788 | 0.79 | KIF11 (0.47) | KIF11ALDH1A1TSHRCES2CES1 | |
| SCHEMBL2533168 | 0.79 | APP (0.42) | CYP1A2 | |
| SCHEMBL29144381 | 0.76 | KIF11 (0.48) | KIF11ALDH1A1TSHRCES2CES1 | |
| SCHEMBL3827578 | 0.76 | KIF11 (0.48) | KIF11ALDH1A1TSHRCES2CES1 | |
| SCHEMBL28409237 | 0.76 | KIF11 (0.48) | KIF11ALDH1A1TSHRCES2CES1 | |
| SCHEMBL21332570 | 0.76 | RARB (0.52) | KIF11ALDH1A1TSHRCYP1A2 | |
| SCHEMBL5539093 | 0.76 | KIF11 (0.48) | KIF11ALDH1A1TSHRCES2CES1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115197046-B | Halogenation method of unsaturated hydrocarbon | 华南理工大学 | 2023-12-15 | — | — | CN | disclosed |
| CN-115197046-A | Halogenation method of unsaturated hydrocarbon | 华南理工大学 | 2022-10-18 | — | — | CN | disclosed |
| CN-110683971-B | Method for synthesizing aryl acetylene alkyl sulfone compounds based on Hantzsch esters | 台州学院 | 2021-09-10 | — | — | CN | disclosed |
| CN-110698369-B | Method for synthesizing aryl acetylene alkyl sulfone compound based on alkyl fluoborate | 台州学院 | 2021-08-24 | — | — | CN | disclosed |
| US-20210017110-A1 | POLYCYCLIC AROMATIC COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME | Board of Regents of the Nevada System Higher Education, on behalf of the University of Nevada, Reno (US) | 2021-01-21 | — | — | US | disclosed |
| EP-3762363-A1 | POLYCYCLIC AROMATIC COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME | Board of Regents of the Nevada System of Higher Education, on Behalf of the University of Nevada, Reno (US) | 2021-01-13 | — | — | EP | disclosed |
| CN-111819166-A | Polycyclic aromatic compounds and methods of making and using the same | 内华达高等教育系统董事会代表内华达大学雷诺分校 | 2020-10-23 | — | — | CN | disclosed |
| CN-110698369-A | Method for synthesizing aryl acetylene alkyl sulfone compound based on alkyl fluoborate | 台州学院 | 2020-01-17 | — | — | CN | disclosed |
| CN-110683971-A | Method for synthesizing aryl acetylene alkyl sulfone compounds based on Hantzsch esters | 台州学院 | 2020-01-14 | — | — | CN | disclosed |
| WO-2019173243-A1 | POLYCYCLIC AROMATIC COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME | BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION, ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) | 2019-09-12 | — | — | WO | 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-20210017110-A1 | POLYCYCLIC AROMATIC COMPOUNDS AND METHODS FOR MAKING AND USING THE SAME | AHR, PAH, ALKBH3 | KIF11 4037/4885ALDH1A1 327/4885TSHR 4778/4885 |
“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.