SCHEMBL13200526

SCHEMBL13200526

CC(C)(C)c1cc(CC(=O)Nc2ccc(Oc3ccccc3)cc2)no1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 17/20 0.67
MAPK13 O15264 1/20 0.67
MAPK12 P53778 1/20 0.67
MAPK11 Q15759 1/20 0.67
MAPK14 Q16539 1/20 0.67
FLT3 P36888 2/20 0.58
RIPK2 O43353 1/20 0.54
MEN1 O00255 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53

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
SCHEMBL13199940 0.91 FLT3 (0.65) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL13199989 0.85 FLT3 (0.53) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL13200000 0.85 MAPT (0.53) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL13200014 0.84 FLT3 (0.53) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL13199938 0.82 FLT3 (0.55) MAPK13MAPK12MAPK11MAPK14FLT3
SCHEMBL13200627 0.81 FLT3 (0.48) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL13200035 0.81 FLT3 (0.69) RAF1FLT3MEN1NPC1RAB9A
SCHEMBL13199994 0.80 FLT3 (0.47) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL13199947 0.80 FLT3 (0.53) RAF1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5573447 0.80 RAF1 (1.00) RAF1MAPK13MAPK12MAPK11MAPK14

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
US-7767670-B2 Substituted 3-carboxamido isoxazoles as kinase modulators AMBIT BIOSCIENCES CORPORATION (US) 2010-08-03 US disclosed
US-7767670-B2 Substituted 3-carboxamido isoxazoles as kinase modulators AMBIT BIOSCIENCES CORPORATION (US) 2010-08-03 US disclosed