SCHEMBL7573028

SCHEMBL7573028

O=S(=O)(Nc1ccc(Br)c(Br)c1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.63
HDAC1 Q13547 3/20 0.56
HDAC8 Q9BY41 3/20 0.56
SMN1; SMN2 Q16637 1/20 0.53
MAPT P10636 1/20 0.52
HDAC3 O15379 2/20 0.51
HDAC4 P56524 2/20 0.51
HDAC7 Q8WUI4 2/20 0.51
HDAC2 Q92769 2/20 0.51
HDAC10 Q969S8 2/20 0.51
HDAC11 Q96DB2 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
HDAC9 Q9UKV0 2/20 0.51
HDAC5 Q9UQL6 2/20 0.51
TP53 P04637 1/20 0.50
DRD2 P14416 1/20 0.48
DRD3 P35462 1/20 0.48
KCNH2 Q12809 1/20 0.48
RORC P51449 1/20 0.47
FFAR1 O14842 1/20 0.47

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
SCHEMBL7588229 0.86 PGR (0.53) FFAR4HDAC1HDAC8SMN1; SMN2MAPT
SCHEMBL7590053 0.84 FFAR4 (0.59) FFAR4HDAC1HDAC8SMN1; SMN2MAPT
SCHEMBL1471295 0.83 FFAR4 (0.54) FFAR4HDAC1HDAC8SMN1; SMN2MAPT
SCHEMBL7569815 0.81 CYP19A1 (0.68) FFAR4SMN1; SMN2MAPT
SCHEMBL28913958 0.81 KIF11 (0.69) FFAR4HDAC1HDAC8SMN1; SMN2MAPT
SCHEMBL26536689 0.81 FFAR4 (0.63) FFAR4HDAC1HDAC8SMN1; SMN2MAPT
SCHEMBL26536700 0.81 PKM (0.70) FFAR4HDAC1HDAC8SMN1; SMN2MAPT
SCHEMBL26537243 0.81 SMN1; SMN2 (0.66) FFAR4HDAC1HDAC8SMN1; SMN2MAPT
SCHEMBL7570513 0.80 FFAR4 (0.64) FFAR4HDAC1HDAC8SMN1; SMN2MAPT
SCHEMBL26536740 0.78 FFAR4 (0.60) FFAR4HDAC1HDAC8SMN1; SMN2MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1239852-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS Arrow Therapeutics Limited (GB) 2002-09-18 EP disclosed
WO-2001028537-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS ARROW THERAPEUTICS LIMITED (GB) 2001-04-26 WO disclosed