Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.49 |
| ▸ | CES1 | P23141 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
| ▸ | F2 | P00734 | 1/20 | 0.46 |
| ▸ | PLG | P00747 | 1/20 | 0.46 |
| ▸ | PLAU | P00749 | 1/20 | 0.46 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.46 |
| ▸ | KLK1 | P06870 | 1/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2705465 | 0.84 | CES2 (0.61) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19309856 | 0.82 | CES2 (0.53) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9165319 | 0.82 | ALDH1A1 (0.49) | SMN1; SMN2ALDH1A1F2CA12CA1 | |
| SCHEMBL30278793 | 0.82 | F2 (0.53) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8205322 | 0.82 | F2 (0.53) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4866982 | 0.81 | ALDH1A1 (0.50) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL14118767 | 0.80 | F2 (0.52) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30684671 | 0.80 | CA12 (0.59) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL571295 | 0.80 | CA12 (0.59) | CES2CES1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19333083 | 0.80 | ALDH1A1 (0.59) | NPC1RAB9ASMN1; SMN2ALDH1A1GAA |
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-10676427-B2 | Diazomethylation reagent and process for using it | FUNDACIÓ INSTITUT CATALÀ D'INVESTIGACIÓ QUÍMICA (ICIQ) (ES) | 2020-06-09 | — | — | 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-10676427-B2 | Diazomethylation reagent and process for using it | DDT, DDC, CYP2E1 | CES2 99/4885CES1 516/4885NPC1 2902/4885 |
“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.