Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | VCP | P55072 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 4/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25771 | 0.78 | ALDH1A1 (0.45) | ALDH1A1CYP2C19VCPACHECYP19A1 | |
| SCHEMBL10759367 | 0.78 | CYP2C19 (0.50) | ALDH1A1CYP2C19VCPACHECYP19A1 | |
| Bromide SCHEMBL7268772 | 0.77 | CYP2C19 (0.49) | ALDH1A1CYP2C19VCPACHECYP19A1 | |
| Water SCHEMBL7268737 | 0.77 | ALDH1A1 (0.49) | ALDH1A1CYP2C19VCPACHECYP19A1 | |
| SCHEMBL3042994 | 0.77 | CYP2C19 (0.52) | ALDH1A1CYP2C19VCPACHECYP19A1 | |
| SCHEMBL8911523 | 0.75 | ATM (0.48) | ALDH1A1CYP2C19ACHECA1CA2 | |
| SCHEMBL910620 | 0.74 | ACHE (0.50) | ALDH1A1CYP2C19ACHECA1CA2 | |
| SCHEMBL20592075 | 0.73 | ALDH1A1 (0.49) | ALDH1A1CYP2C19VCPACHECYP19A1 | |
| Bicarbonate SCHEMBL7262670 | 0.73 | CYP2C19 (0.52) | ALDH1A1CYP2C19ACHECA1CA2 | |
| SCHEMBL4099979 | 0.73 | ACHE (0.54) | ALDH1A1CYP2C19VCPACHECA1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2751291-A2 | METHODS FOR PREPARING HIGH THROUGHPUT PEPTIDOMIMETICS, ORALLY BIOAVAILABLE DRUGS AND COMPOSITIONS CONTAINING SAME | University of Southern California (US) | 2014-07-09 | — | — | EP | disclosed |
| WO-2013033636-A2 | METHODS FOR PREPARING HIGH THROUGHPUT PEPTIDOMIMETICS, ORALLY BIOAVAILABLE DRUGS AND COMPOSITIONS CONTAINING SAME | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 2013-03-07 | — | — | WO | disclosed |
| US-7301041-B2 | Bi-functional metallocenes, preparation process and use in the labeling or biological molecules | BIO MERIEUX (FR) | 2007-11-27 | — | — | US | disclosed |
| US-20060252051-A1 | Method for producing diverse libraries of encoded polymers | JOHN HOPKINS UNIVERSITY, THE | 2006-11-09 | — | — | US | disclosed |
| US-20050038234-A1 | Such as 1-[3-O-dimethoxytritylpropyl]-1'-[3'-O-(2-cyanoethyl-N,N-diisopropylphosphoramidityl)propyl]ferrocene for solid phase synthesis of oligonucleotides/peptides | BIO MERIEUX | 2005-02-17 | — | — | US | disclosed |
| WO-2004087730-A2 | METHOD FOR PRODUCING DIVERSE LIBRARIES OF ENCODED POLYMERS | THE JOHNS HOPKINS UNIVERSITY (US) | 2004-10-14 | — | — | 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 (2 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-20050038234-A1 | Such as 1-[3-O-dimethoxytritylpropyl]-1'-[3'-O-(2-cyanoethyl-N,N-diisopropylphosphoramidityl)propyl]ferrocene for solid phase synthesis of oligonucleotides/peptides | FTH1, DOHH, NSUN2 | ALDH1A1 4008/4885CYP2C19 4285/4885VCP 4007/4885 |
| US-20060252051-A1 | Method for producing diverse libraries of encoded polymers | NSUN3, TRMT1, TARBP1 | ALDH1A1 4039/4885CYP2C19 4159/4885VCP 1133/4885 |
“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.