Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PDK1 | Q15118 | 11/20 | 0.44 |
| ▸ | PDK2 | Q15119 | 11/20 | 0.44 |
| ▸ | PDK3 | Q15120 | 11/20 | 0.44 |
| ▸ | PDK4 | Q16654 | 11/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 3/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16900582 | 0.81 | ALDH1A1 (0.49) | ALDH1A1MEN1HPGDKMT2AGAA | |
| SCHEMBL3895440 | 0.76 | HTT (0.47) | ALDH1A1MEN1HPGDKMT2AGAA | |
| SCHEMBL4041645 | 0.76 | HTT (0.47) | ALDH1A1MEN1HPGDKMT2AGAA | |
| SCHEMBL31009038 | 0.76 | HTT (0.47) | ALDH1A1MEN1HPGDKMT2AGAA | |
| Hydrochloric Acid SCHEMBL9737645 | 0.74 | ALDH1A1 (0.43) | ALDH1A1MEN1HPGDKMT2AGAA | |
| SCHEMBL10105431 | 0.73 | ALDH1A1 (0.42) | ALDH1A1MEN1HPGDKMT2AGAA | |
| SCHEMBL14283936 | 0.72 | ALDH1A1 (0.44) | ALDH1A1MEN1HPGDKMT2AGAA | |
| SCHEMBL31733731 | 0.72 | PDK1 (0.45) | MAPTPDK1PDK2PDK3PDK4 | |
| SCHEMBL10105246 | 0.71 | ALDH1A1 (0.40) | ALDH1A1MEN1HPGDKMT2AGAA | |
| SCHEMBL111786 | 0.70 | MAOA (0.47) | MAPTKDM4ESMN1; SMN2 |
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-20200140404-A1 | HETEROCYCLYL POLYMETHINE IR CHROMOPHORES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA | 2020-05-07 | — | — | 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-20200140404-A1 | HETEROCYCLYL POLYMETHINE IR CHROMOPHORES | SMARCE1, SMARCD1, WDR82 | ALDH1A1 4321/4885MEN1 4025/4885HPGD 2434/4885 |
“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.