SCHEMBL25565865

SCHEMBL25565865

COc1cc(C(F)(F)F)nc(OC)c1[S+]([O-])Nc1noc2cc(Cn3cccn3)cc(OCF)c12

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KAT7 O95251 20/20 0.54
KAT6A Q92794 20/20 0.54
KAT6B Q8WYB5 10/20 0.49
KAT5 Q92993 10/20 0.49
KAT8 Q9H7Z6 10/20 0.49

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
SCHEMBL25565884 0.90 KAT7 (0.49) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25565842 0.88 KAT7 (0.52) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25565931 0.88 KAT7 (0.47) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25565814 0.87 KAT7 (0.53) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL27184166 0.83 KAT7 (0.65) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL30360825 0.83 KAT7 (0.65) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25564128 0.83 KAT7 (0.58) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25563914 0.81 KAT7 (0.57) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25565415 0.81 KAT6A (0.56) KAT7KAT6AKAT6BKAT5KAT8
SCHEMBL25564199 0.79 KAT7 (0.54) 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