SCHEMBL13705602

SCHEMBL13705602

CC(C)c1cccc(-c2c[nH]c3ncc(NC(=O)c4c(F)ccc(N)c4F)cc23)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 8/20 0.62
PRKD3 O94806 5/20 0.62
MAP4K4 O95819 5/20 0.62
NTRK1 P04629 5/20 0.62
AXL P30530 5/20 0.62
FLT4 P35916 5/20 0.62
FLT3 P36888 5/20 0.62
CLK2 P49760 5/20 0.62
MAP4K2 Q12851 5/20 0.62
CAMK2B Q13554 5/20 0.62
CAMK2G Q13555 5/20 0.62
CAMK2D Q13557 5/20 0.62
PTK6 Q13882 5/20 0.62
NTRK3 Q16288 5/20 0.62
PKN2 Q16513 5/20 0.62
MINK1 Q8N4C8 5/20 0.62
PRKD2 Q9BZL6 5/20 0.62
SLK Q9H2G2 5/20 0.62
CLK4 Q9HAZ1 5/20 0.62
MKNK2 Q9HBH9 5/20 0.62

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
SCHEMBL13705600 0.85 PRKD3 (0.63) BTKPRKD3MAP4K4NTRK1AXL
SCHEMBL13705608 0.85 DYRK1A (0.68) BTKPRKD3MAP4K4NTRK1AXL
SCHEMBL13705611 0.84 BTK (0.59) BTKPRKD3MAP4K4NTRK1AXL
SCHEMBL1772473 0.83 BRAF (0.71) BRAF
SCHEMBL13705612 0.83 CLK4 (0.64) BTKPRKD3MAP4K4NTRK1AXL
SCHEMBL13705558 0.80 PRKD3 (0.56) BTKPRKD3MAP4K4NTRK1AXL
SCHEMBL13705606 0.80 PRKD3 (0.58) BTKPRKD3MAP4K4NTRK1AXL
SCHEMBL13705556 0.80 PRKD3 (0.61) BTKPRKD3MAP4K4NTRK1AXL
SCHEMBL13705609 0.79 CDK1 (0.54) BTKPRKD3MAP4K4NTRK1AXL
SCHEMBL13705620 0.78 BRAF (0.49) BTKPRKD3MAP4K4NTRK1AXL

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-2009111278-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2009-09-11 WO disclosed