SCHEMBL30679196

SCHEMBL30679196

CCOC(=O)c1cccc(N2N=C(C)/C(=C/c3ccc(-c4ccc(Cl)c(C(=O)Nc5ccc(OC)c(OC)c5)c4)o3)C2=O)c1

nearest known ligand 0.85

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
XPA P23025 17/20 0.85
MEN1 O00255 1/20 0.62
APEX1 P27695 1/20 0.62
NTSR1 P30989 1/20 0.62
GALK1 P51570 1/20 0.62
KMT2A Q03164 1/20 0.62
EP300 Q09472 1/20 0.58
PTPN1 P18031 1/20 0.53

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
SCHEMBL19644250 0.92 XPA (1.00) XPAMEN1APEX1NTSR1GALK1
SCHEMBL19644251 0.92 XPA (1.00) XPAMEN1APEX1NTSR1GALK1
SCHEMBL20840283 0.92 XPA (1.00) XPAMEN1APEX1NTSR1GALK1
SCHEMBL29385593 0.92 XPA (0.85) XPAMEN1APEX1NTSR1GALK1
SCHEMBL19654076 0.92 XPA (0.85) XPAMEN1APEX1NTSR1GALK1
SCHEMBL19644385 0.86 XPA (0.88) XPAMEN1APEX1NTSR1GALK1
SCHEMBL19644527 0.86 XPA (0.88) XPAMEN1APEX1NTSR1GALK1
SCHEMBL19644529 0.86 XPA (0.88) XPAMEN1APEX1NTSR1GALK1
SCHEMBL30679197 0.85 XPA (0.85) XPAMEN1APEX1NTSR1GALK1
SCHEMBL29524675 0.85 XPA (0.75) XPAMEN1APEX1NTSR1GALK1

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 1 patent. 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