Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.47 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.47 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.46 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SCN1A | P35498 | 1/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.43 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2969494 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL19126196 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL28191065 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL17064993 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL38666225 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL38666622 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| Water SCHEMBL23198430 | 0.98 | CXCR4 (0.49) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL15363110 | 0.98 | CXCR4 (0.49) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| Fluoride SCHEMBL30331126 | 0.98 | CXCR4 (0.49) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| Hydrochloric Acid SCHEMBL30330428 | 0.98 | CXCR4 (0.51) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10299475-B2 | Pesticide | ISHIHARA SANGYO KAISHA, LTD. (JP) | 2019-05-28 | — | — | US | disclosed |
| US-20130288112-A1 | CYCLIC QUATERNARY AMMONIUM SALT, NONAQUEOUS SOLVENT, NONAQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE | SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) | 2013-10-31 | — | — | US | disclosed |
| WO-2008109177-A2 | METALLOPROTEASE INHIBITORS CONTAINING A HETEROCYCLIC MOIETY | ALANTOS PHARMACEUTICALS HOLDING, INC. (US) | 2008-09-12 | — | — | WO | 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-10299475-B2 | Pesticide | DDT, ACHE, KCNH1 | CXCR4 4455/4885ALDH1A1 1980/4885L3MBTL1 175/4885 |
“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.