SCHEMBL25564467

SCHEMBL25564467

COc1cccc(OC)c1[S+]([O-])Nc1noc2cc(Oc3ccccn3)cc(OC)c12

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 17/20 0.42
KAT7 O95251 16/20 0.42
KAT6B Q8WYB5 8/20 0.42
KAT5 Q92993 5/20 0.36
KAT8 Q9H7Z6 5/20 0.36
KCNA5 P22460 1/20 0.35
SGMS2 Q8NHU3 2/20 0.35
SGMS1 Q86VZ5 1/20 0.35

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
SCHEMBL25566914 0.80 KAT6A (0.35) KAT6AKAT7KAT6BSGMS2SGMS1
SCHEMBL22817409 0.80 KAT6A (0.67) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL25561707 0.80 KAT6A (0.67) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL30360820 0.80 KAT6A (0.67) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL22817457 0.78 KAT6A (0.68) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL21609073 0.78 KAT6A (0.40) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL25566025 0.77 HCRTR1 (0.35) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL31432518 0.77 KAT6A (0.38) KAT6AKAT7KAT6B
SCHEMBL25564465 0.77 KAT6A (0.38) KAT6AKAT7KAT6B
SCHEMBL21609189 0.76 KAT6A (0.41) KAT6AKAT7KAT6BKAT5KAT8

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