SCHEMBL20179259

SCHEMBL20179259

CC(=O)ONC(=O)CCC(Cc1ccc(C(=O)OC(C)(C)C)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 4/20 0.39
SLC7A5 Q01650 1/20 0.39
CA2 P00918 2/20 0.36
CA9 Q16790 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA14 Q9ULX7 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
LTA4H P09960 1/20 0.35
TMPRSS6 Q8IU80 3/20 0.35
F2 P00734 2/20 0.35
SMO Q99835 1/20 0.35
CACNA1B Q00975 4/20 0.34
ELANE P08246 1/20 0.34
LOXL2 Q9Y4K0 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
SCHEMBL20168728 0.93 HTT (0.41) FOLH1CA2CA9CA12CA1
SCHEMBL20168753 0.92 CYP4F2 (0.40) FOLH1CA2CA9CA12CA1
SCHEMBL20168587 0.91 FOLH1 (0.50) FOLH1SLC7A5CA2CA9LTA4H
SCHEMBL20179177 0.88 FOLH1 (0.37) FOLH1SLC7A5CA2CA9CA12
SCHEMBL20179143 0.87 SLC7A5 (0.56) FOLH1SLC7A5LTA4HTMPRSS6F2
SCHEMBL20179211 0.86 FOLH1 (0.36) FOLH1SLC7A5CA2CA9CA12
SCHEMBL21577939 0.86 SLC7A5 (0.40) FOLH1SLC7A5CA2CA9CA12
SCHEMBL20179137 0.86 FOLH1 (0.54) FOLH1SLC7A5SMO
SCHEMBL20179243 0.85 FOLH1 (0.42) FOLH1SLC7A5LTA4HCACNA1BELANE
SCHEMBL20168730 0.82 CPA3 (0.46) FOLH1SLC7A5CA2CA9CA12

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11866394-B2 Prodrugs of hydroxamate-based GCPII inhibitors THE JOHNS HOPKINS UNIVERSTY (US) 2024-01-09 US disclosed
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 (4 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 FOLH1 10/4885SLC7A5 505/4885CA2 828/4885
US-20210355079-A1 PRODRUGS OF HYDROXAMATE-BASED GCPII INHIBITORS TPI1, HPGDS, GPI FOLH1 39/4885SLC7A5 463/4885CA2 918/4885
US-11059775-B2 Prodrug compositions and utility of hydroxamate-based GCPII inhibitors GLS, HPGDS, GPI FOLH1 15/4885SLC7A5 536/4885CA2 779/4885
US-11866394-B2 Prodrugs of hydroxamate-based GCPII inhibitors TPI1, HPGDS, GPI FOLH1 39/4885SLC7A5 463/4885CA2 918/4885

“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.