SCHEMBL2568971

SCHEMBL2568971

CS(=O)(=O)c1cccc(-c2n[nH]c3ccc(N)cc23)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TTK P33981 10/20 0.58
PDPK1 O15530 1/20 0.57
MAP3K5 Q99683 1/20 0.57
LRRK2 Q5S007 2/20 0.56
MAPK8 P45983 1/20 0.55
AURKA O14965 1/20 0.52
MAP2K4 P45985 2/20 0.49
AXL P30530 1/20 0.49
PLK4 O00444 1/20 0.48
MAP2K7 O14733 1/20 0.48
JAK2 O60674 1/20 0.48

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
Trifluoroacetic Acid SCHEMBL2557436 0.90 TTK (0.52) TTKPDPK1MAP3K5LRRK2MAPK8
SCHEMBL2563513 0.88 TTK (0.74) TTKMAPK8MAP2K4
Hydrochloric Acid SCHEMBL2557647 0.87 TTK (0.73) TTKMAPK8MAP2K4
SCHEMBL922900 0.81 JAK2 (0.70) TTKPDPK1MAP3K5LRRK2PLK4
SCHEMBL2570707 0.81 MAPK1 (0.57) TTKPDPK1MAP3K5LRRK2MAP2K4
Trifluoroacetic Acid SCHEMBL2555732 0.79 TTK (0.65) TTKMAPK8MAP2K4
SCHEMBL31423230 0.77 DCLK1 (0.65) TTKLRRK2AURKAMAP2K4AXL
SCHEMBL4008208 0.77 DCLK1 (0.65) TTKLRRK2AURKAMAP2K4AXL
SCHEMBL22890746 0.76 AURKA (0.52) TTKPDPK1LRRK2MAPK8AURKA
SCHEMBL29644074 0.76 AURKA (0.52) TTKPDPK1LRRK2MAPK8AURKA

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