SCHEMBL13200046

SCHEMBL13200046

CC(C)(C)c1cc(NC(=O)Cc2ccc(NC(=O)c3cccnc3)cc2)no1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 10/20 0.76
SMN1; SMN2 Q16637 2/20 0.72
RAF1 P04049 2/20 0.57
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
RET P07949 4/20 0.51
ROCK1 Q13464 1/20 0.51

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
SCHEMBL13200037 0.89 FLT3 (0.73) FLT3SMN1; SMN2RAF1NPC1RAB9A
SCHEMBL13234668 0.86 FLT3 (1.00) FLT3SMN1; SMN2RAF1NPC1RAB9A
SCHEMBL13200580 0.84 FLT3 (0.72) FLT3RAF1NPC1RAB9ARET
SCHEMBL13200025 0.84 FLT3 (0.60) FLT3SMN1; SMN2RAF1NPC1RAB9A
SCHEMBL13200126 0.84 FLT3 (0.58) FLT3SMN1; SMN2RAF1NPC1RAB9A
SCHEMBL13200615 0.83 FLT3 (0.62) FLT3RAF1RET
SCHEMBL13200041 0.83 FLT3 (0.62) FLT3RAF1RETROCK1
SCHEMBL13200061 0.82 FLT3 (0.61) FLT3SMN1; SMN2RAF1NPC1RAB9A
SCHEMBL13200072 0.82 FLT3 (0.59) FLT3NPC1RAB9ARET
SCHEMBL13200131 0.82 FLT3 (0.60) FLT3RAF1RETROCK1

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