SCHEMBL22482912

SCHEMBL22482912

O=NNC(=O)c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 15/20 0.78
HDAC8 Q9BY41 11/20 0.78
HDAC11 Q96DB2 8/20 0.78
HDAC3 O15379 3/20 0.78
HDAC2 Q92769 2/20 0.63
HDAC1 Q13547 1/20 0.63
HDAC7 Q8WUI4 1/20 0.63
HDAC10 Q969S8 1/20 0.63
HDAC9 Q9UKV0 1/20 0.63
HDAC5 Q9UQL6 1/20 0.63
KCNA5 P22460 1/20 0.50
TAS2R14 Q9NYV8 2/20 0.48
LMNA P02545 2/20 0.48
TP53 P04637 2/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL22482724 0.89 HDAC6 (0.81) HDAC6HDAC8HDAC11HDAC3HDAC2
SCHEMBL22482773 0.88 HDAC6 (1.00) HDAC6HDAC8HDAC11HDAC3HDAC2
SCHEMBL22483006 0.82 HDAC6 (1.00) HDAC6HDAC8HDAC11HDAC3HDAC2
SCHEMBL22482991 0.80 HDAC6 (1.00) HDAC6HDAC8HDAC11HDAC3HDAC2
SCHEMBL22483015 0.80 HDAC6 (1.00) HDAC6HDAC8HDAC11HDAC3HDAC2
SCHEMBL22468210 0.78 HDAC6 (1.00) HDAC6HDAC8HDAC11HDAC3HDAC2
SCHEMBL22482769 0.77 HDAC6 (1.00) HDAC6HDAC8HDAC11HDAC3HDAC2
SCHEMBL24472715 0.76 HDAC6 (0.70) HDAC6HDAC8HDAC11HDAC3HDAC2
SCHEMBL22483024 0.76 HDAC6 (0.81) HDAC6HDAC8HDAC11HDAC3HDAC2
SCHEMBL22483014 0.76 HDAC6 (0.78) HDAC6HDAC8HDAC11HDAC3HDAC2

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-2020194272-A1 HALOGENATED PHENYLSULFONAMIDE HYDROXAMIC ACID COMPOUNDS, COMPOSITIONS AND USES THEREOF AS SELECTIVE HDAC6 INHIBITORS 2681603 ONTARIO INC. (CA) 2020-10-01 WO disclosed