Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | CDC25A | P30304 | 1/20 | 0.38 |
| ▸ | CDC25C | P30307 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | ITK | Q08881 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18347517 | 0.91 | IDO1 (0.51) | IDO1ALDH1A1CYP2A6CDC25ACDC25C | |
| SCHEMBL13564568 | 0.89 | IDO1 (0.42) | IDO1ALDH1A1CYP2A6MAOBNOS3 | |
| SCHEMBL13563983 | 0.84 | MAOB (0.48) | ALDH1A1CDC25ACDC25CMAOBNOS1 | |
| SCHEMBL18347522 | 0.83 | IDO1 (0.48) | IDO1ALDH1A1CYP2A6MAOBNOS3 | |
| SCHEMBL16906001 | 0.83 | IDO1 (0.45) | IDO1ALDH1A1CYP2A6CDC25ACDC25C | |
| SCHEMBL18347519 | 0.81 | IDO1 (0.46) | IDO1MAOBHSD17B3ARTDO2 | |
| SCHEMBL548396 | 0.80 | IDO1 (0.45) | IDO1ALDH1A1CYP2A6MAOBNOS3 | |
| SCHEMBL16273138 | 0.78 | IDO1 (0.38) | IDO1ALDH1A1CDC25ACDC25CMAOB | |
| SCHEMBL13564574 | 0.77 | CYP2A6 (0.44) | IDO1ALDH1A1CYP2A6NOS3NOS1 | |
| SCHEMBL18862505 | 0.76 | IDO1 (0.37) | IDO1ALDH1A1CDC25ACDC25CMAOB |
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-10032993-B2 | Aromatic heterocyclic compound, manufacturing method thereof, organic semiconductor material, and organic semiconductor device | NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) | 2018-07-24 | — | — | 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-10032993-B2 | Aromatic heterocyclic compound, manufacturing method thereof, organic semiconductor material, and organic semiconductor device | PAH, TYR, SLCO2A1 | IDO1 631/4885ALDH1A1 2073/4885CYP2A6 1180/4885 |
“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.