Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21709418 | 0.94 | NUDT1 (0.40) | NUDT1ADORA2ASCN9A | |
| SCHEMBL21709288 | 0.93 | NUDT1 (0.44) | NUDT1ADORA2ASCN9A | |
| SCHEMBL21679716 | 0.93 | NUDT1 (0.44) | NUDT1ADORA2ASCN9A | |
| SCHEMBL21709281 | 0.92 | NUDT1 (0.42) | NUDT1ADORA2ASCN9A | |
| SCHEMBL21709368 | 0.92 | NUDT1 (0.42) | NUDT1ADORA2ASCN9A | |
| SCHEMBL21709210 | 0.89 | NUDT1 (0.40) | NUDT1SCN9A | |
| SCHEMBL21709370 | 0.88 | ALOX5 (0.34) | NUDT1 | |
| SCHEMBL21709377 | 0.88 | NUDT1 (0.47) | NUDT1ADORA2ASCN9A | |
| SCHEMBL21709205 | 0.87 | NUDT1 (0.38) | NUDT1ADORA2ASCN9A | |
| SCHEMBL21709280 | 0.87 | NUDT1 (0.34) | NUDT1ADORA2A |
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-20200048207-A1 | COMPOUNDS WITH ARYLAMINE STRUCTURES | MERCK PATENT GMBH (DE) | 2020-02-13 | — | — | 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-20200048207-A1 | COMPOUNDS WITH ARYLAMINE STRUCTURES | DDT, NAT1, INMT | NUDT1 15/4885ADORA2A 319/4885SCN9A 1893/4885 |
“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.