SCHEMBL19644173

SCHEMBL19644173

COc1cccc(NC(=O)c2cc(-c3ccc(/C=C4/C(=O)N(c5cccc(C(=O)O)c5)N=C4C)o3)ccc2Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
XPA P23025 14/20 1.00
EP300 Q09472 1/20 0.66
MEN1 O00255 2/20 0.61
APEX1 P27695 2/20 0.61
KMT2A Q03164 2/20 0.61
KDM4E B2RXH2 1/20 0.61
POLB P06746 1/20 0.61
MAPT P10636 1/20 0.61
THRB P10828 1/20 0.61
RECQL P46063 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
PTPN1 P18031 1/20 0.60
GSK3A P49840 1/20 0.60
NTSR1 P30989 1/20 0.59
GALK1 P51570 1/20 0.59

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
SCHEMBL19644175 1.00 XPA (1.00) XPAEP300MEN1APEX1KMT2A
SCHEMBL19644185 1.00 XPA (1.00) XPAEP300MEN1APEX1KMT2A
SCHEMBL19644341 0.94 XPA (1.00) XPAEP300MEN1APEX1KMT2A
SCHEMBL22205249 0.94 XPA (1.00) XPAEP300MEN1APEX1KMT2A
SCHEMBL19644342 0.94 XPA (1.00) XPAEP300MEN1APEX1KMT2A
SCHEMBL19654076 0.92 XPA (0.85) XPAEP300MEN1APEX1KMT2A
SCHEMBL29385593 0.92 XPA (0.85) XPAEP300MEN1APEX1KMT2A
SCHEMBL22482115 0.92 XPA (0.84) XPAEP300MEN1APEX1KMT2A
SCHEMBL20840283 0.91 XPA (1.00) XPAEP300MEN1APEX1KMT2A
SCHEMBL19644251 0.91 XPA (1.00) XPAEP300MEN1APEX1KMT2A

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
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-20200308154-A1 KU INHIBITORS AND THEIR USE INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2020-10-01 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 (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-20220089577-A1 KU INHIBITORS AND THEIR USE ZFR, XRCC6, ZFX XPA 66/4885EP300 771/4885MEN1 2172/4885
US-20200308154-A1 KU INHIBITORS AND THEIR USE ZFR, XRCC6, ZFX XPA 66/4885EP300 771/4885MEN1 2172/4885

“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.