Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 7/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | ACP1 | P24666 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18804886 | 0.83 | PDK2 (0.51) | PDK2NPSR1CYP2A6TDP1SLC6A3 | |
| SCHEMBL22876004 | 0.81 | TRPM4 (0.44) | PDK2THRBTDP1ALDH1A1HPGD | |
| SCHEMBL19395211 | 0.80 | PDK2 (0.49) | PDK2CYP2A6MEN1KMT2AALDH1A1 | |
| SCHEMBL19395213 | 0.80 | PDK2 (0.49) | PDK2CYP2A6MEN1KMT2AALDH1A1 | |
| SCHEMBL17656822 | 0.79 | ALDH1A1 (0.46) | PDK2CYP2A6THRBTDP1MEN1 | |
| SCHEMBL18804882 | 0.79 | PDK2 (0.50) | PDK2NPSR1CYP2A6TDP1SLC6A3 | |
| SCHEMBL19395202 | 0.78 | PDK2 (0.50) | PDK2CYP2A6SLC6A3MEN1KMT2A | |
| SCHEMBL19395204 | 0.78 | PDK2 (0.50) | PDK2CYP2A6SLC6A3MEN1KMT2A | |
| SCHEMBL22876001 | 0.78 | SLC6A3 (0.45) | PDK2NPSR1CYP2A6THRBTDP1 | |
| SCHEMBL19869579 | 0.77 | PDK2 (0.43) | PDK2CYP2A6MEN1KMT2AALDH1A1 |
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-20170125684-A1 | NOVEL SPIRO ORGANIC COMPOUND | NANJING TOPTO MATERIALS CO., LTD. (CN) | 2017-05-04 | — | — | US | disclosed |
| US-20170125684-A1 | NOVEL SPIRO ORGANIC COMPOUND | NANJING TOPTO MATERIALS CO., LTD. (CN) | 2017-05-04 | — | — | US | disclosed |
| US-20170125677-A1 | NOVEL ORGANIC COMPOUND, MATERIAL COMPRISING THE SAME FOR ORGANIC ELECTROLUMINESCENCE DEVICES, AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE MATERIAL | NANJING TOPTO MATERIALS CO., LTD. (CN) | 2017-05-04 | — | — | US | disclosed |
| US-20170125677-A1 | NOVEL ORGANIC COMPOUND, MATERIAL COMPRISING THE SAME FOR ORGANIC ELECTROLUMINESCENCE DEVICES, AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE MATERIAL | NANJING TOPTO MATERIALS CO., LTD. (CN) | 2017-05-04 | — | — | 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-20170125677-A1 | NOVEL ORGANIC COMPOUND, MATERIAL COMPRISING THE SAME FOR ORGANIC ELECTROLUMINESCENCE DEVICES, AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE MATERIAL | SLCO4C1, PIEZO1, TRPA1 | PDK2 2700/4885NPSR1 2559/4885CYP2A6 3702/4885 |
| US-20170125684-A1 | NOVEL SPIRO ORGANIC COMPOUND | PKD1, LEF1, FOXO1 | PDK2 700/4885NPSR1 3868/4885CYP2A6 1185/4885 |
“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.