SCHEMBL1711795

SCHEMBL1711795

CNC1CCC(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 3/20 0.54
USP30 Q70CQ3 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
KDM4E B2RXH2 1/20 0.54
RECQL P46063 1/20 0.54
MMP2 P08253 2/20 0.54
MMP9 P14780 2/20 0.54
MMP1 P03956 1/20 0.54
MMP3 P08254 1/20 0.54
MMP13 P45452 1/20 0.54
MMP14 P50281 1/20 0.54
ALDH1A1 P00352 4/20 0.51
PARG Q86W56 1/20 0.50
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
DCK P27707 1/20 0.49
CA12 O43570 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
IDH2 P48735 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
SCHEMBL28713447 0.92 SMN1; SMN2 (0.63) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL12852936 0.90 KDM4E (0.56) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL23052370 0.85 KDM4E (0.76) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL1723222 0.84 UCHL1 (0.54) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL12418055 0.84 KDM4E (0.73) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL12418061 0.84 KDM4E (0.73) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL1711827 0.84 SMN1; SMN2 (0.54) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL1722654 0.81 UCHL1 (0.49) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL1711630 0.81 UCHL1 (0.54) UCHL1USP30SMN1; SMN2KDM4ERECQL
SCHEMBL8355420 0.81 KDM4E (0.67) UCHL1USP30SMN1; SMN2KDM4ERECQL

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-2344449-A1 ARYL-PHENYL-SULFONAMIDO-CYCLOALKYL COMPOUNDS AND THEIR USE Pimco 2664 Limited (GB) 2011-07-20 EP disclosed