Zopolrestat

Zopolrestat

SCHEMBL7180777

O=C(O)Cc1nn(Cc2nc3cc(C(F)(F)F)ccc3s2)c(=O)c2ccccc12.OCCNCCO

nearest known ligand 0.87

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGIRfolP

The experimentally established mechanism targets of Zopolrestat. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 20/20 0.87
AKR1B10 O60218 1/20 0.87
AKR1A1 P14550 1/20 0.87
GLO1 Q04760 1/20 0.87

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
Zopolrestat SCHEMBL49012 0.93 AKR1B1 (1.00) AKR1B1AKR1B10AKR1A1GLO1
Zopolrestat SCHEMBL8505122 0.93 AKR1B1 (1.00) AKR1B1AKR1B10AKR1A1GLO1
Zopolrestat SCHEMBL29353641 0.93 AKR1B1 (1.00) AKR1B1AKR1B10AKR1A1GLO1
Zopolrestat SCHEMBL8129027 0.92 AKR1B1 (0.98) AKR1B1AKR1B10AKR1A1GLO1
Zopolrestat SCHEMBL7185596 0.92 AKR1B1 (0.90) AKR1B1AKR1B10AKR1A1GLO1
Zopolrestat SCHEMBL7179887 0.90 AKR1B1 (0.87) AKR1B1AKR1B10AKR1A1GLO1
Zopolrestat SCHEMBL15939730 0.85 AKR1B1 (0.84) AKR1B1AKR1B10AKR1A1GLO1
Zopolrestat SCHEMBL7565103 0.85 AKR1B1 (0.84) AKR1B1AKR1B10AKR1A1GLO1
Zopolrestat SCHEMBL8129830 0.85 AKR1B1 (0.83) AKR1B1AKR1B10AKR1A1GLO1
Zopolrestat SCHEMBL15939751 0.84 AKR1B1 (0.81) AKR1B1AKR1B10AKR1A1GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212072-A1 Salts of zopolrestat MYLARI BANAVARA L (US) 2003-11-13 US claimed
US-6570013-B2 (4-oxo-(5-trifluoromethyl-benzothiazol-2-ylmethyl)-3,4-dihydro -phthalazin-1-yl)-acetic acid ethanolamine salt, useful for treating diabetic complication in a mammal PFIZER INC 2003-05-27 US claimed
WO-2002098429-A1 ETHANOLAMINE, DIETHANOLAMINE OR TRIETHANOLAMINE SALT OF ZOPOLRESTAT PFIZER PRODUCTS INC. (US) 2002-12-12 WO claimed
US-20010056095-A1 Salts of zopolrestat MYLARI BANAVARA L (US) 2001-12-27 US claimed
US-20030212072-A1 Salts of zopolrestat MYLARI BANAVARA L (US) 2003-11-13 US disclosed
US-6570013-B2 (4-oxo-(5-trifluoromethyl-benzothiazol-2-ylmethyl)-3,4-dihydro -phthalazin-1-yl)-acetic acid ethanolamine salt, useful for treating diabetic complication in a mammal PFIZER INC 2003-05-27 US disclosed
WO-2002098429-A1 ETHANOLAMINE, DIETHANOLAMINE OR TRIETHANOLAMINE SALT OF ZOPOLRESTAT PFIZER PRODUCTS INC. (US) 2002-12-12 WO disclosed
US-20010056095-A1 Salts of zopolrestat MYLARI BANAVARA L (US) 2001-12-27 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 (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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010056095-A1 Salts of zopolrestat SLC5A1, SLC5A2, SLC2A1 AKR1B1 385/4885AKR1B10 636/4885AKR1A1 487/4885
US-20030212072-A1 Salts of zopolrestat SLC5A1, SLC5A2, SLC2A1 AKR1B1 385/4885AKR1B10 636/4885AKR1A1 487/4885

“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.