SCHEMBL5372937

SCHEMBL5372937

C=CS(=O)(=O)Nc1ccc(-c2cncc(C(=O)Nc3c(C)cccc3C)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.58
PDGFRA P16234 1/20 0.47
KDR P35968 1/20 0.47
SCN10A Q9Y5Y9 5/20 0.46
PIP4K2A P48426 4/20 0.43
PIP4K2B P78356 4/20 0.43
KCNH2 Q12809 1/20 0.43
SCN2A Q99250 1/20 0.42
CCNC P24863 3/20 0.42
CDK8 P49336 3/20 0.42
EPHB4 P54760 1/20 0.41
BTK Q06187 1/20 0.41
S1PR4 O95977 1/20 0.40

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
SCHEMBL14495029 0.91 CHRNA7 (0.52) CHRNA7PDGFRAKDRSCN10APIP4K2A
SCHEMBL5335824 0.85 CHRNA7 (0.55) CHRNA7SCN10AKCNH2SCN2ACCNC
SCHEMBL5312257 0.84 CHRNA7 (0.61) CHRNA7PDGFRAKDRSCN10AKCNH2
SCHEMBL5313234 0.80 CHRNA7 (0.49) CHRNA7PDGFRAKDRSCN10ASCN2A
SCHEMBL14573319 0.80 CHRNA7 (0.70) CHRNA7SCN10AKCNH2SCN2ACCNC
SCHEMBL5315263 0.79 CHRNA7 (0.69) CHRNA7SCN10AKCNH2SCN2ACCNC
SCHEMBL14494780 0.78 CHRNA7 (0.59) CHRNA7SCN10AKCNH2SCN2ACCNC
SCHEMBL14494777 0.78 CHRNA7 (0.55) CHRNA7SCN10AKCNH2SCN2ACCNC
SCHEMBL5313064 0.77 CHRNA7 (0.66) CHRNA7SCN10AKCNH2SCN2ACCNC
SCHEMBL5317038 0.77 BTK (0.57) CHRNA7PDGFRAKDREPHB4BTK

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
WO-2007062459-A1 SELECTIVE KINASE INHIBITORS BASED ON PYRIDINE SCAFFOLD CYTOPIA RESEARCH PTY LTD (AU) 2007-06-07 WO disclosed