Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | F2 | P00734 | 3/20 | 0.47 |
| ▸ | F10 | P00742 | 3/20 | 0.47 |
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 3/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10352210 | 0.97 | ALDH1A1 (0.56) | CYP19A1ALDH1A1HPGDF2F10 | |
| SCHEMBL10352809 | 0.87 | CYP19A1 (0.54) | CYP19A1ALDH1A1HPGDF2F10 | |
| SCHEMBL31168160 | 0.86 | CYP19A1 (0.67) | CYP19A1ALDH1A1HPGDMAOBNPSR1 | |
| SCHEMBL5145150 | 0.86 | CYP19A1 (0.67) | CYP19A1ALDH1A1HPGDMAOBNPSR1 | |
| SCHEMBL1374021 | 0.86 | CYP19A1 (0.67) | CYP19A1ALDH1A1HPGDMAOBNPSR1 | |
| SCHEMBL10352215 | 0.85 | CYP19A1 (0.47) | CYP19A1ALDH1A1HPGDF2F10 | |
| SCHEMBL9745656 | 0.84 | ALDH1A1 (0.61) | CYP19A1ALDH1A1HPGDMAOBNPSR1 | |
| SCHEMBL5143806 | 0.84 | ALDH1A1 (0.61) | CYP19A1ALDH1A1HPGDMAOBNPSR1 | |
| SCHEMBL9746267 | 0.84 | ALDH1A1 (0.61) | CYP19A1ALDH1A1HPGDMAOBNPSR1 | |
| SCHEMBL9746946 | 0.84 | ALDH1A1 (0.61) | CYP19A1ALDH1A1HPGDMAOBNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8362239-B2 | Heteroaromatic phthalonitriles | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2013-01-29 | — | — | US | disclosed |
| US-20120232270-A1 | HETEROAROMATIC PHTHALONITRILES | THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2012-09-13 | — | — | US | disclosed |
| US-8222403-B2 | Heteroaromatic phthalonitriles | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2012-07-17 | — | — | US | disclosed |
| US-20110108755-A1 | HETEROAROMATIC PHTHALONITRILES | THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2011-05-12 | — | — | 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 (2 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-20120232270-A1 | HETEROAROMATIC PHTHALONITRILES | ARNT, PBRM1, NR4A1 | CYP19A1 1685/4885ALDH1A1 1493/4885HPGD 1536/4885 |
| US-20110108755-A1 | HETEROAROMATIC PHTHALONITRILES | ARNT, PBRM1, NR4A1 | CYP19A1 1685/4885ALDH1A1 1493/4885HPGD 1536/4885 |
“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.