SCHEMBL4739074

SCHEMBL4739074

CS(=O)(=O)c1ncc2cc(-c3ccccc3F)c(=O)n(CC3CC3)c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 6/20 0.46
SIK2 Q9H0K1 5/20 0.42
STK26 Q9P289 2/20 0.42
STK4 Q13043 1/20 0.42
STK3 Q13188 1/20 0.42
STK24 Q9Y6E0 1/20 0.42
SRC P12931 2/20 0.41
BTK Q06187 2/20 0.41
LYN P07948 1/20 0.41
PAK1 Q13153 7/20 0.41
SIK1 P57059 4/20 0.39
SIK3 Q9Y2K2 4/20 0.39
PAK2 Q13177 2/20 0.39
PAK3 O75914 1/20 0.39
MAP2K4 P45985 1/20 0.39
TEK Q02763 1/20 0.39
MELK Q14680 1/20 0.39
PKN3 Q6P5Z2 1/20 0.39
NLK Q9UBE8 1/20 0.39
MAP4K5 Q9Y4K4 1/20 0.39

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
SCHEMBL4182680 0.89 TNK2 (0.46) TNK2SIK2STK26STK4STK3
SCHEMBL4738003 0.81 RIPK2 (0.51) SRCABL1
SCHEMBL4178516 0.76 TNK2 (0.48) TNK2SIK2STK26STK4STK3
SCHEMBL1060740 0.73 MERTK (0.38) GNRHR
SCHEMBL20564687 0.72 BTK (0.50) SRCBTKLYN
SCHEMBL4169067 0.71 TNK2 (0.45) TNK2SIK2STK26STK4STK3
SCHEMBL27265461 0.71 USP30 (0.42) TNK2SRCLYN
SCHEMBL4091072 0.71 RIPK2 (0.48) TNK2SIK2PAK1SIK1SIK3
SCHEMBL4181003 0.71 PAK1 (0.51) TNK2SIK2STK26STK4STK3
SCHEMBL20564688 0.70 RIPK2 (0.51) SIK2STK26STK4STK3STK24

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-2008078249-A1 ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2008-07-03 WO disclosed