SCHEMBL25564680

SCHEMBL25564680

COc1cccc(OC)c1[S+]([O-])Nc1noc2nc(Cn3cccn3)cc(OC)c12

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KAT7 O95251 19/20 0.46
KAT6A Q92794 19/20 0.46
KAT6B Q8WYB5 15/20 0.46
KAT5 Q92993 13/20 0.46
KAT8 Q9H7Z6 13/20 0.46
PDE4B Q07343 1/20 0.42

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
SCHEMBL30020281 0.81 KAT7 (0.70) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25561771 0.81 KAT7 (0.70) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL22817330 0.79 KAT7 (0.69) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL22817393 0.78 KAT7 (0.69) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL30019841 0.77 PDE4B (0.45) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25564685 0.77 PDE4B (0.45) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25563986 0.76 KAT7 (0.62) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL22817394 0.75 KAT7 (0.67) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25563914 0.74 KAT7 (0.57) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25564128 0.74 KAT7 (0.58) KAT7KAT6AKAT6BKAT5KAT8

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
WO-2023088233-A1 LYSINE ACETYLTRANSFERASE 6A (KAT6A) INHIBITORS AND USES THEREOF INSILICO MEDICINE IP LIMITED (CN) 2023-05-25 WO disclosed