SCHEMBL21570565

SCHEMBL21570565

C=CCCC(Cc1ccc(C(=O)OC)cc1)(C(=O)OC)C(=O)OC

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPRB P23467 8/20 0.55
LOXL2 Q9Y4K0 1/20 0.45
PTPN1 P18031 3/20 0.42
CYP4A11 Q02928 2/20 0.42
CYP4F2 P78329 1/20 0.41
PTPN2 P17706 2/20 0.40
PTPRA P18433 1/20 0.40
PTPRC P08575 1/20 0.40
PTPRG P23470 1/20 0.40
ACP1 P24666 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL20168700 0.89 PTPRB (0.46) PTPRBLOXL2PTPN1CYP4A11CYP4F2
SCHEMBL20179180 0.89 CYP4F2 (0.46) PTPRBPTPN1CYP4A11CYP4F2PTPN2
SCHEMBL14508896 0.85 PTPRB (0.56) PTPRBLOXL2CYP4A11CYP4F2RAB9A
SCHEMBL20168723 0.83 PTPN1 (0.44) PTPRBPTPN1CYP4A11CYP4F2PTPN2
SCHEMBL20179260 0.83 PTPRB (0.60) PTPRBLOXL2PTPN1CYP4A11CYP4F2
SCHEMBL21577933 0.81 PTPRB (0.50) PTPRBLOXL2CYP4A11CYP4F2CA1
SCHEMBL21578075 0.81 PTPRB (0.40) PTPRBPTPN1PTPN2PTPRAPTPRC
SCHEMBL14508881 0.80 PTPRB (0.38) PTPRBLOXL2PTPN1CYP4A11CYP4F2
SCHEMBL2490598 0.80 PTPRB (0.46) PTPRBLOXL2PTPN1CYP4A11CYP4F2
SCHEMBL9133768 0.76 CYP4A11 (0.60) LOXL2CYP4A11CYP4F2NPC1RAB9A

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 7 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-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-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
US-20190352255-A1 NOVEL PRODRUG COMPOSITIONS AND UTILITY OF HYDROXAMATE-BASED GCPII INHIBITORS THE JOHNS HOPKINS UNIVERSITY 2019-11-21 US 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 PTPRB 2860/4885LOXL2 1675/4885PTPN1 2645/4885
US-20210355079-A1 PRODRUGS OF HYDROXAMATE-BASED GCPII INHIBITORS TPI1, HPGDS, GPI PTPRB 2479/4885LOXL2 1853/4885PTPN1 2594/4885
US-11059775-B2 Prodrug compositions and utility of hydroxamate-based GCPII inhibitors GLS, HPGDS, GPI PTPRB 2894/4885LOXL2 1774/4885PTPN1 2389/4885
US-11866394-B2 Prodrugs of hydroxamate-based GCPII inhibitors TPI1, HPGDS, GPI PTPRB 2479/4885LOXL2 1853/4885PTPN1 2594/4885

“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.