SCHEMBL7574097

SCHEMBL7574097

COC(=O)c1ccc(NS(=O)(=O)c2c(F)cccc2F)c(NS(=O)(=O)c2c(F)cccc2F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.51
CYP2C9 P11712 5/20 0.49
KDM4E B2RXH2 3/20 0.48
HSD17B10 Q99714 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ALDH1A1 P00352 5/20 0.47
TSHR P16473 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HPGD P15428 2/20 0.46
MAPT P10636 1/20 0.46
POLB P06746 1/20 0.46
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
CCR2 P41597 1/20 0.44
PKM P14618 1/20 0.44
TCF4 P15884 2/20 0.43
CTNNB1 P35222 2/20 0.43
LMNA P02545 1/20 0.43
SLC40A1 Q9NP59 1/20 0.43
PYGL P06737 1/20 0.43

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
SCHEMBL7570489 0.87 LMNA (0.52) KDM4ESMN1; SMN2ALDH1A1TSHRNPSR1
SCHEMBL1126923 0.80 LMNA (0.54) ACLYKDM4ESMN1; SMN2ALDH1A1TSHR
SCHEMBL7569777 0.80 CYP2C9 (0.64) CYP2C9KDM4EHSD17B10ALDH1A1TSHR
SCHEMBL1726830 0.78 ACLY (0.56) ACLYKDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL1127264 0.77 FFAR4 (0.50) KDM4ESMN1; SMN2ALDH1A1TSHRHPGD
SCHEMBL30464235 0.77 FFAR4 (0.50) KDM4ESMN1; SMN2ALDH1A1TSHRHPGD
SCHEMBL7593482 0.76 SLC40A1 (0.57) POLBCCR2PKMLMNASLC40A1
SCHEMBL3237044 0.76 KDM4E (0.77) CYP2C9KDM4EHSD17B10SMN1; SMN2ALDH1A1
SCHEMBL7567314 0.76 NPSR1 (0.59) ACLYCYP2C9ALDH1A1NPSR1CCR2
SCHEMBL22146044 0.75 ALPL (0.56) POLBTCF4CTNNB1LMNA

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