SCHEMBL4708923

SCHEMBL4708923

CC(CNCc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)c2ccccc2)s1)C1CCCCCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
PKM P14618 1/20 0.45
LMNA P02545 5/20 0.36
POLB P06746 3/20 0.36
ALDH1A1 P00352 3/20 0.35
MCOLN3 Q8TDD5 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
TYMS P04818 1/20 0.34
CA2 P00918 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
LOX P28300 2/20 0.33
THRB P10828 1/20 0.33
MAOA P21397 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL14343958 0.87 KDM4E (0.42) KDM4EPKMLMNAPOLBMEN1
SCHEMBL4185920 0.81 KDM4E (0.42) KDM4EPKMLMNAPOLBALDH1A1
SCHEMBL4192333 0.81 KDM4E (0.42) KDM4EPKMLMNAPOLBALDH1A1
SCHEMBL4191258 0.81 KDM4E (0.42) KDM4EPKMLMNAPOLBALDH1A1
SCHEMBL4197783 0.80 KDM4E (0.41) KDM4EPKMLMNAPOLBALDH1A1
SCHEMBL4708104 0.79 PKM (0.56) KDM4EPKMLMNAPOLBALDH1A1
SCHEMBL4706508 0.79 KDM4E (0.40) KDM4EPKMPOLBMAPT
SCHEMBL4709526 0.78 KDM4E (0.54) KDM4EPKMLMNAPOLBALDH1A1
SCHEMBL4708309 0.78 LMNA (0.41) KDM4EPKMLMNAPOLBALDH1A1
SCHEMBL4709081 0.78 KDM4E (0.39) KDM4EPKMLMNAPOLBALDH1A1

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-1879877-A2 ANTIMICROBIAL AGENTS Ranbaxy Laboratories Limited (IN) 2008-01-23 EP disclosed
WO-2006117762-A2 ANTIMICROBIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO disclosed