SCHEMBL29389131

SCHEMBL29389131

CCOC(=O)c1cccc(N2N=C(C)CC2=O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.58
MAPT P10636 6/20 0.58
KMT2A Q03164 5/20 0.58
KDM4E B2RXH2 5/20 0.58
APP P05067 2/20 0.55
MEN1 O00255 4/20 0.54
ALDH1A1 P00352 4/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
CYP1A2 P05177 1/20 0.54
CHRM2 P08172 1/20 0.54
CYP3A4 P08684 1/20 0.54
CHRM1 P11229 1/20 0.54
TSHR P16473 1/20 0.54
PTGS1 P23219 1/20 0.54
DRD3 P35462 1/20 0.54
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52
ALOX5 P09917 1/20 0.52

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
SCHEMBL19644103 1.00 GAA (0.58) GAAMAPTKMT2AKDM4EAPP
SCHEMBL2228950 0.87 MAPT (0.60) GAAMAPTKMT2AKDM4EAPP
SCHEMBL20840284 0.85 GAA (0.53) GAAMAPTKMT2AKDM4EMEN1
SCHEMBL4661824 0.84 MAPT (0.61) GAAMAPTKMT2AKDM4EAPP
SCHEMBL2221283 0.83 KMT2A (0.71) GAAMAPTKMT2AKDM4EAPP
SCHEMBL2854377 0.83 MAPT (0.65) GAAMAPTKMT2AKDM4EAPP
SCHEMBL12756285 0.79 MAPT (0.81) GAAMAPTKMT2AKDM4EAPP
SCHEMBL9454642 0.78 ATM (0.64) GAAMAPTKMT2AKDM4EMEN1
SCHEMBL4662959 0.76 MAPT (0.70) GAAMAPTKMT2AKDM4EAPP
SCHEMBL125079 0.75 MAPT (0.74) GAAMAPTKMT2AKDM4EAPP

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3684354-B1 XPA INHIBITOR COMPOUNDS AND THEIR USE UNIV INDIANA RES & TECH CORP (US) 2023-11-15 EP disclosed
US-20220089577-A1 KU INHIBITORS AND THEIR USE UNIV INDIANA RES & TECH CORP (US) 2022-03-24 US disclosed
EP-3463371-B1 KU INHIBITORS AND THEIR USE UNIV INDIANA RES & TECH CORP (US) 2022-02-23 EP 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 (1 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-20220089577-A1 KU INHIBITORS AND THEIR USE ZFR, XRCC6, ZFX GAA 719/4885MAPT 3583/4885KMT2A 317/4885

“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.