SCHEMBL19644233

SCHEMBL19644233

CC1=NN(c2cccc(C(=O)O)c2)C(=O)C1=Cc1ccc(-c2ccc(C(=O)NCc3ccc(F)cc3)cc2)o1

nearest known ligand 0.84

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
XPA P23025 13/20 0.84
GSK3A P49840 1/20 0.61
SIRT5 Q9NXA8 1/20 0.57
KDM4E B2RXH2 1/20 0.56
MEN1 O00255 1/20 0.56
POLB P06746 1/20 0.56
MAPT P10636 1/20 0.56
THRB P10828 1/20 0.56
APEX1 P27695 1/20 0.56
RECQL P46063 1/20 0.56
KMT2A Q03164 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
EP300 Q09472 1/20 0.54
PTPN1 P18031 1/20 0.54

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
SCHEMBL19644267 1.00 XPA (0.84) XPAGSK3ASIRT5KDM4EMEN1
SCHEMBL19644232 1.00 XPA (0.84) XPAGSK3ASIRT5KDM4EMEN1
SCHEMBL19644404 0.92 XPA (1.00) XPASIRT5KDM4EMEN1POLB
SCHEMBL19644491 0.92 XPA (1.00) XPASIRT5KDM4EMEN1POLB
SCHEMBL19644405 0.92 XPA (1.00) XPASIRT5KDM4EMEN1POLB
SCHEMBL29524572 0.91 XPA (0.73) XPAGSK3ASIRT5KDM4EMEN1
SCHEMBL19644469 0.90 XPA (1.00) XPAGSK3AKDM4EMEN1POLB
SCHEMBL19644210 0.90 XPA (1.00) XPAGSK3AKDM4EMEN1POLB
SCHEMBL19644209 0.90 XPA (1.00) XPAGSK3AKDM4EMEN1POLB
SCHEMBL19652473 0.85 GSK3A (0.77) XPAGSK3ASIRT5KDM4EMEN1

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
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
US-11207296-B2 XPA inhibitor compounds and their use INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2021-12-28 US disclosed
US-20200308154-A1 KU INHIBITORS AND THEIR USE INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2020-10-01 US disclosed
US-20200222367-A1 XPA INHIBITOR COMPOUNDS AND THEIR USE INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2020-07-16 US disclosed
EP-3463371-A1 KU INHIBITORS AND THEIR USE Indiana University Research & Technology Corporation (US) 2019-04-10 EP disclosed
WO-2017205503-A1 KU INHIBITORS AND THEIR USE INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2017-11-30 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-20220089577-A1 KU INHIBITORS AND THEIR USE ZFR, XRCC6, ZFX XPA 66/4885GSK3A 2359/4885SIRT5 3104/4885
US-20200222367-A1 XPA INHIBITOR COMPOUNDS AND THEIR USE XPOT, XPA, ERCC4 XPA 2/4885GSK3A 667/4885SIRT5 3078/4885
US-11207296-B2 XPA inhibitor compounds and their use XPOT, XPA, ERCC4 XPA 2/4885GSK3A 667/4885SIRT5 3078/4885
US-20200308154-A1 KU INHIBITORS AND THEIR USE ZFR, XRCC6, ZFX XPA 66/4885GSK3A 2359/4885SIRT5 3104/4885

“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.