Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 4/20 | 0.32 |
| ▸ | ACHE | P22303 | 4/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.32 |
| ▸ | PTGFR | P43088 | 2/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | DHODH | Q02127 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29661841 | 0.90 | GRM2 (0.39) | KDM4ECYP1A2ALDH1A1TSHRGRM2 | |
| SCHEMBL17054193 | 0.90 | GRM2 (0.39) | KDM4ECYP1A2ALDH1A1TSHRGRM2 | |
| SCHEMBL17054083 | 0.84 | KDM4E (0.44) | KDM4ECYP1A2ALDH1A1TSHRGRM2 | |
| SCHEMBL28773717 | 0.82 | GRM2 (0.50) | KDM4ECYP1A2ALDH1A1TSHRGRM2 | |
| SCHEMBL17054094 | 0.80 | KDM4E (0.59) | KDM4ECYP1A2ALDH1A1TSHRKMT2A | |
| SCHEMBL17054196 | 0.80 | CYP1A2 (0.37) | KDM4ECYP1A2ALDH1A1TSHRGRM2 | |
| SCHEMBL29661864 | 0.80 | CYP1A2 (0.37) | KDM4ECYP1A2ALDH1A1TSHRGRM2 | |
| SCHEMBL29661821 | 0.80 | KDM4E (0.59) | KDM4ECYP1A2ALDH1A1TSHRKMT2A | |
| SCHEMBL17054088 | 0.79 | CYP1A2 (0.60) | KDM4ECYP1A2ALDH1A1TSHRMEN1 | |
| SCHEMBL29661981 | 0.79 | CYP1A2 (0.60) | KDM4ECYP1A2ALDH1A1TSHRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-10696635-B2 | Versatile ligand for palladium-catalyzed meta-C—H functionalizations of aromatic substrates | THE SCRIPPS RESEARCH INSTITUTE (US) | 2020-06-30 | — | — | US | disclosed |
| US-10611723-B2 | Ligand-enabled meta-C-H activation using a transient mediator | THE SCRIPPS RESEARCH INSTITUTE (US) | 2020-04-07 | — | — | US | disclosed |
| US-20190119212-A1 | A VERSATILE LIGAND FOR PALLADIUM-CATALYZED META-C-H FUNCTIONALIZATIONS | THE SCRIPPS RESEARCH INSTITUTE | 2019-04-25 | — | — | US | disclosed |
| WO-2017184589-A1 | A VERSATILE LIGAND FOR PALLADIUM-CATALYZED META-C-H FUNCTIONALIZATIONS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2017-10-26 | — | — | WO | disclosed |
| WO-2016123361-A1 | LIGAND-ENABLED META-C-H ACTIVATION USING A TRANSIENT MEDIATOR | THE SCRIPPS RESEARCH INSTITUTE (US) | 2016-08-04 | — | — | WO | disclosed |
| WO-2015131100-A1 | LIGAND-CONTROLLED C(SP3)-H ARYLATION AND OLEFINATION IN SYNTHESIS OF UNNATURAL CHIRAL ALPHA AMINO ACIDS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2015-09-03 | — | — | 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 (3 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-10611723-B2 | Ligand-enabled meta-C-H activation using a transient mediator | HRH4, AHR, HRH3 | KDM4E 3368/4885CYP1A2 1268/4885ALDH1A1 2756/4885 |
| US-20190119212-A1 | A VERSATILE LIGAND FOR PALLADIUM-CATALYZED META-C-H FUNCTIONALIZATIONS | AHR, PAH, DOHH | KDM4E 3516/4885CYP1A2 28/4885ALDH1A1 208/4885 |
| US-10696635-B2 | Versatile ligand for palladium-catalyzed meta-C—H functionalizations of aromatic substrates | PAH, AHR, DDC | KDM4E 3453/4885CYP1A2 15/4885ALDH1A1 121/4885 |
“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.