Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT1 | P54687 | 7/20 | 0.49 |
| ▸ | BCAT2 | O15382 | 2/20 | 0.49 |
| ▸ | AR | P10275 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29779335 | 1.00 | BCAT1 (0.49) | BCAT1BCAT2ARHPGDCYP1A2 | |
| SCHEMBL24823990 | 0.81 | AR (0.52) | BCAT1BCAT2ARHPGDALDH1A1 | |
| SCHEMBL24823987 | 0.81 | AR (0.46) | BCAT1BCAT2ARALDH1A1IMPDH2 | |
| SCHEMBL24825590 | 0.81 | BCAT1 (0.46) | BCAT1BCAT2ARSLC22A12 | |
| SCHEMBL24824846 | 0.81 | BCAT1 (0.48) | BCAT1BCAT2ARALDH1A1IMPDH2 | |
| SCHEMBL24825943 | 0.78 | BCAT1 (0.55) | BCAT1BCAT2ARIMPDH2 | |
| SCHEMBL24823981 | 0.78 | BCAT1 (0.53) | BCAT1BCAT2ARCYP1A2CYP2C9 | |
| SCHEMBL24825509 | 0.77 | NLRP3 (0.48) | BCAT1BCAT2ARHPGDCYP1A2 | |
| SCHEMBL29779328 | 0.77 | NLRP3 (0.48) | BCAT1BCAT2ARHPGDCYP1A2 | |
| SCHEMBL24825932 | 0.74 | MEN1 (0.45) | BCAT1BCAT2ARHPGDALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220411381-A1 | PYRIMIDINEDIONE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2022-12-29 | — | — | 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-20220411381-A1 | PYRIMIDINEDIONE DERIVATIVES | DPYD, TYMP, TYMS | BCAT1 2999/4885BCAT2 3754/4885AR 2511/4885 |
“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.