Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.73 |
| ▸ | P4HB | P07237 | 2/20 | 0.69 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.67 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.66 |
| ▸ | ATM | Q13315 | 1/20 | 0.64 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.64 |
| ▸ | RELA | Q04206 | 1/20 | 0.62 |
| ▸ | ESR1 | P03372 | 1/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.60 |
| ▸ | MAOA | P21397 | 3/20 | 0.57 |
| ▸ | MAOB | P27338 | 3/20 | 0.57 |
| ▸ | CA1 | P00915 | 2/20 | 0.57 |
| ▸ | CA2 | P00918 | 2/20 | 0.57 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | COMT | P21964 | 1/20 | 0.56 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL1801639 | 1.00 | CYP1B1 (0.73) | CYP1B1P4HBHSD17B3PTPN1ATM | |
| SCHEMBL16939641 | 0.95 | CYP1B1 (0.67) | CYP1B1P4HBHSD17B3PTPN1ATM | |
| SCHEMBL13203470 | 0.93 | CYP1B1 (0.77) | CYP1B1P4HBHSD17B3PTPN1ATM | |
| SCHEMBL25283293 | 0.90 | ESR1 (0.67) | CYP1B1P4HBHSD17B3ATMGPR55 | |
| SCHEMBL29406397 | 0.90 | ESR1 (0.67) | CYP1B1P4HBHSD17B3ATMGPR55 | |
| SCHEMBL31233016 | 0.90 | ESR1 (0.67) | CYP1B1P4HBHSD17B3ATMGPR55 | |
| SCHEMBL25193875 | 0.90 | ESR1 (0.67) | CYP1B1P4HBHSD17B3ATMGPR55 | |
| SCHEMBL8735847 | 0.90 | CYP1B1 (0.68) | CYP1B1P4HBHSD17B3PTPN1ATM | |
| SCHEMBL5873207 | 0.90 | CYP1B1 (0.68) | CYP1B1P4HBHSD17B3PTPN1ATM | |
| SCHEMBL5873205 | 0.90 | CYP1B1 (0.68) | CYP1B1P4HBHSD17B3PTPN1ATM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7951827-B2 | Synthesis and antiprotozoal activity of dicationic 3,5-diphenylisoxazoles | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2011-05-31 | — | — | US | disclosed |
| US-20060264487-A1 | Synthesis and antiprotozoal activity of dicationic 3,5-diphenylisoxazoles | TIDWELL RICHARD R | 2006-11-23 | — | — | US | disclosed |
| EP-1719767-A1 | Synthesis and antiprotozoal activity of dicationic 3,5-diphenylisoxazoles | The University of North Carolina at Chapel Hill (US) | 2006-11-08 | — | — | EP | 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-20060264487-A1 | Synthesis and antiprotozoal activity of dicationic 3,5-diphenylisoxazoles | PFAS, DHPS, DDO | CYP1B1 1228/4885P4HB 1304/4885HSD17B3 3930/4885 |
“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.