SCHEMBL1920369

SCHEMBL1920369

O=Cc1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.64
HDAC4 P56524 1/20 0.64
HDAC1 Q13547 1/20 0.64
HDAC7 Q8WUI4 1/20 0.64
HDAC2 Q92769 1/20 0.64
HDAC10 Q969S8 1/20 0.64
HDAC11 Q96DB2 1/20 0.64
HDAC8 Q9BY41 1/20 0.64
HDAC6 Q9UBN7 1/20 0.64
HDAC9 Q9UKV0 1/20 0.64
HDAC5 Q9UQL6 1/20 0.64
MAPT P10636 3/20 0.58
CES1 P23141 1/20 0.57
PGR P06401 9/20 0.56
CYP19A1 P11511 1/20 0.55
LMNA P02545 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
TP53 P04637 1/20 0.52
GAA P10253 1/20 0.52
THRB P10828 1/20 0.52

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
SCHEMBL4063073 0.86 HDAC2 (0.62) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29047616 0.85 CYP19A1 (0.73) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL28380387 0.85 PGR (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL15652924 0.85 HDAC1 (0.64) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29571412 0.85 PGR (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL15652958 0.81 KMT2A (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13762642 0.81 HDAC1 (0.78) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13762641 0.81 HDAC1 (0.78) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL28406134 0.81 CES1 (0.76) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29549842 0.81 CES1 (0.76) HDAC3HDAC4HDAC1HDAC7HDAC2

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-2245006-B1 SULFONAMIDES AS OREXIN ANTAGONISTS HOFFMANN LA ROCHE (CH) 2011-06-01 EP disclosed