Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 2/20 | 0.32 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL20745009 | 1.00 | PKM (0.34) | PKMKDM4EALDH1A1CYP4F2CYP4A11 | |
| SCHEMBL20745215 | 0.76 | GPR55 (0.36) | THRBGPR55TSHR | |
| SCHEMBL20745216 | 0.76 | GPR55 (0.36) | THRBGPR55TSHR | |
| SCHEMBL20744886 | 0.75 | TSHR (0.33) | THRBGPR55TSHR | |
| SCHEMBL20744883 | 0.75 | TSHR (0.33) | THRBGPR55TSHR | |
| SCHEMBL20745005 | 0.75 | MMP8 (0.59) | ALDH1A1THRBLMNAMMP8PIN1 | |
| SCHEMBL20745002 | 0.75 | MMP8 (0.59) | ALDH1A1THRBLMNAMMP8PIN1 | |
| SCHEMBL10067023 | 0.74 | ALDH1A1 (0.41) | ALDH1A1LMNAHSD17B10KMT2AMAPT | |
| SCHEMBL22337957 | 0.72 | GPR55 (0.35) | THRBLMNAHSD17B10GPR55TSHR | |
| SCHEMBL1562023 | 0.71 | ALDH1A1 (0.50) | PKMKDM4EALDH1A1CYP4F2CYP4A11 |
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-10875822-B2 | Directed β-C(sp3)#H iodination and arylation of ketones | THE SCRIPPS RESEARCH INSTITUTE (US) | 2020-12-29 | — | — | US | disclosed |
| US-20200255363-A1 | Directed Beta-C(sp3)–H Iodination and Arylation of Ketones | THE SCRIPPS RESEARCH INSTITUTE | 2020-08-13 | — | — | US | disclosed |
| WO-2019036349-A1 | DIRECTED B-C(SP3)-H IODINATION AND ARYLATION OF KETONES | THE SCRIPPS RESEARCH INSTITUTE (US) | 2019-02-21 | — | — | 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-20200255363-A1 | Directed Beta-C(sp3)–H Iodination and Arylation of Ketones | BCAT1, AOC3, SPIN3 | PKM 1455/4885KDM4E 3610/4885ALDH1A1 1244/4885 |
| US-10875822-B2 | Directed β-C(sp3)#H iodination and arylation of ketones | BCAT1, AOC3, SPIN3 | PKM 1360/4885KDM4E 3320/4885ALDH1A1 1290/4885 |
“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.