Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.36 |
| ▸ | ESR1 | P03372 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31618730 | 0.82 | CYP3A4 (0.42) | BACE1ALOX5PTGS2ESR2ESR1 | |
| SCHEMBL16180654 | 0.73 | APEX1 (0.37) | CA1CA2CA4CA6 | |
| SCHEMBL592990 | 0.73 | APEX1 (0.53) | BACE1ALOX5PTGS2ESR2ESR1 | |
| SCHEMBL45709 | 0.73 | TDP1 (0.47) | CYP3A4TSHRTDP1CA1CA2 | |
| SCHEMBL6544882 | 0.73 | BACE1 (0.47) | BACE1ALOX5PTGS2ESR2ESR1 | |
| SCHEMBL69980 | 0.73 | CYP3A4 (0.65) | BACE1ALOX5PTGS2CYP3A4TSHR | |
| Methane SCHEMBL9716111 | 0.71 | CYP3A4 (0.61) | BACE1ALOX5PTGS2CYP3A4TSHR | |
| SCHEMBL13978630 | 0.69 | — | — | |
| SCHEMBL30375371 | 0.69 | — | — | |
| SCHEMBL23648084 | 0.69 | ALDH1A1 (0.35) | ESR2ESR1TSHRCA1ALDH1A1 |
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-6828466-B2 | Reacting arene with borane; oxidation, hydrogenation phenylboronic acid | BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY | 2004-12-07 | — | — | US | disclosed |
| US-20040030197-A1 | Process for the synthesis of phenols from arenes | BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY | 2004-02-12 | — | — | 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-20040030197-A1 | Process for the synthesis of phenols from arenes | GRHPR, CBR1, CBR3 | BACE1 4096/4885ALOX5 750/4885PTGS2 1326/4885 |
“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.