SCHEMBL7572374

SCHEMBL7572374

CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)c(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.58
LMNA P02545 4/20 0.57
ALDH1A1 P00352 3/20 0.57
KDM4E B2RXH2 1/20 0.57
MAPT P10636 2/20 0.54
HIF1A Q16665 1/20 0.54
KDM1A O60341 2/20 0.53
NHERF1 O14745 1/20 0.51
KMT2A Q03164 3/20 0.50
GAA P10253 1/20 0.50
POLB P06746 1/20 0.49
TSHR P16473 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CYP2C9 P11712 2/20 0.49
MEN1 O00255 1/20 0.49
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 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
SCHEMBL7578595 0.89 NPSR1 (0.72) NPSR1LMNAALDH1A1KDM4EMAPT
SCHEMBL7572555 0.88 CYP2C9 (0.60) NPSR1LMNAALDH1A1KDM4EKDM1A
SCHEMBL7570517 0.79 CYP2C9 (0.61) NPSR1LMNAALDH1A1KDM4EMAPT
SCHEMBL7572561 0.79 NPSR1 (0.66) NPSR1LMNAALDH1A1KDM4EMAPT
SCHEMBL28572592 0.79 MAPT (0.65) NPSR1LMNAALDH1A1KDM4EMAPT
SCHEMBL395600 0.78 HIF1A (0.61) NPSR1LMNAALDH1A1MAPTHIF1A
SCHEMBL1071830 0.78 CYP2C9 (0.79) NPSR1LMNAALDH1A1KDM4EMAPT
SCHEMBL7573951 0.78 NPSR1 (0.59) NPSR1LMNAALDH1A1KDM4EMAPT
SCHEMBL7573948 0.78 NPSR1 (0.59) NPSR1LMNAALDH1A1KDM4EMAPT
SCHEMBL7567314 0.78 NPSR1 (0.59) NPSR1LMNAALDH1A1KMT2AGAA

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