Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SI | P14410 | 1/20 | 0.38 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9327548 | 0.79 | MGAM (0.38) | CYP2D6MGAMGAASIMGAM2 | |
| SCHEMBL9729233 | 0.77 | MAPT (0.53) | CYP2D6MGAMGAASIMGAM2 | |
| SCHEMBL23376910 | 0.72 | MAPT (0.64) | CYP2D6MGAMGAASIMGAM2 | |
| SCHEMBL28794446 | 0.72 | MAPT (0.64) | CYP2D6MGAMGAASIMGAM2 | |
| SCHEMBL7306746 | 0.70 | MAPT (0.47) | CYP2D6MGAMGAASIMGAM2 | |
| SCHEMBL7306734 | 0.70 | MAPT (0.47) | CYP2D6MGAMGAASIMGAM2 | |
| SCHEMBL23130583 | 0.69 | ALDH1A1 (0.35) | GAAALDH1A1TSHRHSD17B10L3MBTL1 | |
| SCHEMBL13868417 | 0.68 | MGAM (0.44) | MGAMGAASIMGAM2ALDH1A1 | |
| SCHEMBL740740 | 0.67 | MGAM (0.48) | CYP2D6MGAMGAASIMGAM2 | |
| SCHEMBL29926915 | 0.67 | MGAM (0.48) | CYP2D6MGAMGAASIMGAM2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7759452-B2 | Aspartic ester functional compounds | BAYER MATERIALSCIENCE LLC (US) | 2010-07-20 | — | — | US | disclosed |
| US-20090142601-A1 | ASPARTIC ESTER FUNCTIONAL COMPOUNDS | COVESTRO LLC | 2009-06-04 | — | — | US | disclosed |
| EP-1627868-B1 | Aspartic ester functional compounds | BAYER MATERIALSCIENCE LLC (US) | 2007-12-19 | — | — | EP | disclosed |
| EP-1627868-A2 | Aspartic ester functional compounds | Bayer MaterialScience LLC (US) | 2006-02-22 | — | — | EP | disclosed |
| US-20060011295-A1 | Aspartic ester functional compounds | BAYER MATERIAL SCIENCE LLC | 2006-01-19 | — | — | 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-20060011295-A1 | Aspartic ester functional compounds | DDO, CDH1, ICAM1 | CYP2D6 4115/4885MGAM 3758/4885GAA 3360/4885 |
“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.