Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 3/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.40 |
| ▸ | CYP46A1 | Q9Y6A2 | 3/20 | 0.38 |
| ▸ | PGR | P06401 | 2/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | CCKBR | P32239 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6905802 | 1.00 | PDE7A (0.48) | PDE7AAKR1B1CYP46A1PGRNR1I2 | |
| SCHEMBL6905795 | 1.00 | PDE7A (0.48) | PDE7AAKR1B1CYP46A1PGRNR1I2 | |
| SCHEMBL29393057 | 0.81 | PDE7A (0.45) | PDE7AAKR1B1CYP46A1PGRNR1I2 | |
| SCHEMBL4088810 | 0.81 | PDE7A (0.45) | PDE7AAKR1B1CYP46A1PGRNR1I2 | |
| SCHEMBL1046528 | 0.81 | PDE7A (0.45) | PDE7AAKR1B1CYP46A1PGRNR1I2 | |
| SCHEMBL1079634 | 0.81 | PDE7A (0.45) | PDE7AAKR1B1CYP46A1PGRNR1I2 | |
| SCHEMBL6905458 | 0.71 | PDE7A (0.48) | PDE7AAKR1B1CYP46A1PGRNR1I2 | |
| SCHEMBL29378147 | 0.66 | PDE7A (0.41) | PDE7AAKR1B1CYP46A1PGRNR1I2 | |
| SCHEMBL1079633 | 0.64 | PDE7A (0.45) | PDE7AAKR1B1CYP46A1PGRNR1I2 | |
| SCHEMBL1046527 | 0.64 | PDE7A (0.45) | PDE7AAKR1B1CYP46A1PGRNR1I2 |
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-20040063734-A1 | 4,4-Disubstituted-3,4-dihydro-2 (1H)-quinazoliniones useful as HIV reverse transcriptase inhibitors | BRISTOL-MYERS SQUIBB COMPANY | 2004-04-01 | — | — | US | claimed |
| US-20040063734-A1 | 4,4-Disubstituted-3,4-dihydro-2 (1H)-quinazoliniones useful as HIV reverse transcriptase inhibitors | BRISTOL-MYERS SQUIBB COMPANY | 2004-04-01 | — | — | 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-20040063734-A1 | 4,4-Disubstituted-3,4-dihydro-2 (1H)-quinazoliniones useful as HIV reverse transcriptase inhibitors | NQO2, DPYD, QTRT1 | PDE7A 324/4885AKR1B1 750/4885CYP46A1 939/4885 |
“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.