SCHEMBL7090587

SCHEMBL7090587

C[S+]([O-])c1ccc(-c2n[nH]c3ccc(-c4cnn[nH]4)cc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 6/20 0.40
MAPK1 P28482 4/20 0.40
MAPKAPK3 Q16644 4/20 0.40
MAPK6 Q16659 4/20 0.40
MAPKAPK2 P49137 3/20 0.40
MAPKAPK5 Q8IW41 2/20 0.40
MKNK1 Q9BUB5 1/20 0.40
AXL P30530 3/20 0.38
JAK2 O60674 2/20 0.37
DYRK1A Q13627 5/20 0.36
CLK2 P49760 4/20 0.36
CLK3 P49761 4/20 0.36
MAP4K4 O95819 2/20 0.36
CDK2 P24941 2/20 0.36
CLK4 Q9HAZ1 2/20 0.36
MKNK2 Q9HBH9 2/20 0.36
IRAK4 Q9NWZ3 2/20 0.36
DCLK1 O15075 1/20 0.36
PRKD3 O94806 1/20 0.36
CHEK2 O96017 1/20 0.36

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
SCHEMBL7092069 0.80 PRKAG1 (0.48) MAP2K4MAPK1MAPKAPK3MAPK6MAPKAPK2
SCHEMBL5381317 0.75 MAP4K4 (0.45) MAP2K4MAPK1MAPKAPK3MAPK6MAPKAPK2
SCHEMBL6509704 0.66 MAP2K4 (0.45) MAP2K4MAPK1MAPKAPK3MAPK6MAPKAPK2
SCHEMBL6844185 0.65 JAK2 (0.40) MKNK1AXLJAK2DYRK1ACLK2
SCHEMBL13411815 0.63 POLB (0.33) MKNK1MKNK2
SCHEMBL8363687 0.63 MAP4K4 (0.46) MAP2K4MAPK1MAPKAPK3MAPK6MAPKAPK2
SCHEMBL17306449 0.62 MKNK1 (0.87) MAP2K4MAPK1MAPKAPK3MAPK6MAPKAPK2
SCHEMBL3667012 0.62 GSK3B (0.57) MAPK1MAPKAPK2JAK2DYRK1ACLK2
SCHEMBL19781587 0.61 MKNK1 (0.54) MAP2K4MAPK1MAPKAPK3MAPK6MAPKAPK2
SCHEMBL5377534 0.60 MKNK1 (0.60) MAPK1MKNK1JAK2CSNK2A1MAPT

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
EP-1313711-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARMACEUTICALS, INC. (US) 2003-05-28 EP disclosed
WO-2002010137-A2 INDAZOLE DERIVATIVES AS JNK INHIBITORS SIGNAL PHARMACEUTICALS, INC. (US) 2002-02-07 WO disclosed