SCHEMBL2566947

SCHEMBL2566947

NS(=O)(=O)c1cccc(-c2n[nH]c3ccc(Br)cc23)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTK P33981 18/20 0.73
MAPK8 P45983 1/20 0.64
MAP2K4 P45985 1/20 0.62
DCLK1 O15075 1/20 0.61
PRKD3 O94806 1/20 0.61
MAP4K4 O95819 1/20 0.61
CHEK2 O96017 1/20 0.61
CSF1R P07333 1/20 0.61
FER P16591 1/20 0.61
CDK2 P24941 1/20 0.61
MARK3 P27448 1/20 0.61
FLT4 P35916 1/20 0.61
FLT3 P36888 1/20 0.61
MAPK9 P45984 1/20 0.61
CSNK1D P48730 1/20 0.61
CLK2 P49760 1/20 0.61
CSNK2A1 P68400 1/20 0.61
CSNK1G2 P78368 1/20 0.61
MAP4K2 Q12851 1/20 0.61
STK3 Q13188 1/20 0.61

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
SCHEMBL2563513 0.85 TTK (0.74) TTKMAPK8MAP2K4
SCHEMBL2567517 0.84 TTK (1.00) TTKMAPK8MAP2K4
Hydrochloric Acid SCHEMBL2557647 0.84 TTK (0.73) TTKMAPK8MAP2K4
SCHEMBL2564335 0.83 TTK (1.00) TTKMAPK8MAP2K4
Hydrochloric Acid SCHEMBL2577139 0.83 TTK (0.71) TTKMAPK8MAP2K4
SCHEMBL2564024 0.82 TTK (0.70) TTKMAPK8MAP2K4
SCHEMBL12281363 0.81 TTK (1.00) TTKMAPK8MAP2K4CHEK2AURKB
SCHEMBL2561009 0.81 TTK (0.72) TTKMAPK8AURKB
SCHEMBL2564814 0.78 TTK (0.67) TTKMAPK8CHEK2AURKB
SCHEMBL2573333 0.77 TTK (1.00) TTKCHEK2AURKB

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
WO-2011123937-A1 KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERSITY HEALTH NETWORK (CA) 2011-10-13 WO disclosed
WO-2011123937-A1 KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERSITY HEALTH NETWORK (CA) 2011-10-13 WO disclosed