SCHEMBL20179253

SCHEMBL20179253

CC(C)C(=O)Oc1ccc(COC(=O)c2ccc(CC(CCC(=O)O)C(=O)OCCS(C)(C)C)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.42
PPARA Q07869 2/20 0.38
ELANE P08246 2/20 0.38
PRSS1 P07477 4/20 0.37
TMPRSS15 P98073 4/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CPA3 P15088 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL20179228 0.88 FOLH1 (0.39) PPARGPPARAELANEKMT2AMEN1
SCHEMBL20168668 0.87 PRSS1 (0.39) PPARGELANEPRSS1TMPRSS15KMT2A
SCHEMBL21578056 0.82 PRSS1 (0.50) PPARGPPARAELANEPRSS1TMPRSS15
SCHEMBL20179212 0.79 CPA3 (0.35) PPARGPRSS1TMPRSS15CPA3
SCHEMBL20168590 0.76 FOLH1 (0.40) PPARGELANEKMT2AMEN1LMNA
SCHEMBL20179200 0.75 FOLH1 (0.51) PPARGPPARAELANEPRSS1TMPRSS15
SCHEMBL23633890 0.74 FOLH1 (0.35) PPARG
SCHEMBL20179271 0.74 ELANE (0.36) PPARGPPARAELANEKMT2AMEN1
SCHEMBL20179269 0.74 ELANE (0.36) PPARGELANEKMT2AMEN1MAPT
SCHEMBL20168293 0.73 PPARG (0.43) PPARGPPARAELANEPRSS1TMPRSS15

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210355079-A1 PRODRUGS OF HYDROXAMATE-BASED GCPII INHIBITORS INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY AS CR V.V.I. (CZ) 2021-11-18 US disclosed
US-11059775-B2 Prodrug compositions and utility of hydroxamate-based GCPII inhibitors THE JOHNS HOPKINS UNIVERSITY (US) 2021-07-13 US disclosed
US-20190352255-A1 NOVEL PRODRUG COMPOSITIONS AND UTILITY OF HYDROXAMATE-BASED GCPII INHIBITORS THE JOHNS HOPKINS UNIVERSITY 2019-11-21 US disclosed
WO-2018094334-A1 PRODRUGS OF HYDROXAMATE-BASED GCPII INHIBITORS THE JOHNS HOPKINS UNIVERSITY (US) 2018-05-24 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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190352255-A1 NOVEL PRODRUG COMPOSITIONS AND UTILITY OF HYDROXAMATE-BASED GCPII INHIBITORS GPI, TPI1, HPGDS PPARG 1130/4885PPARA 3436/4885ELANE 919/4885
US-20210355079-A1 PRODRUGS OF HYDROXAMATE-BASED GCPII INHIBITORS TPI1, HPGDS, GPI PPARG 707/4885PPARA 2643/4885ELANE 1159/4885
US-11059775-B2 Prodrug compositions and utility of hydroxamate-based GCPII inhibitors GLS, HPGDS, GPI PPARG 986/4885PPARA 3192/4885ELANE 715/4885

“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.