SCHEMBL13200091

SCHEMBL13200091

CC(C)(C)c1cc(NC(=O)Cc2ccc(NC(=O)c3ccc4ccccc4n3)cc2)no1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 9/20 0.61
RET P07949 6/20 0.55
CSF1R P07333 3/20 0.55
PDGFRB P09619 1/20 0.55
KIT P10721 1/20 0.55
PDGFRA P16234 1/20 0.55
ROCK1 Q13464 1/20 0.52
NTRK1 P04629 1/20 0.51
RAB9A P51151 2/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
KMT2A Q03164 1/20 0.48
EGFR P00533 1/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.47

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
SCHEMBL13200194 0.88 FLT3 (0.53) FLT3RETCSF1RPDGFRBKIT
SCHEMBL13200063 0.88 FLT3 (0.60) FLT3RETCSF1RPDGFRBKIT
SCHEMBL13234845 0.87 FLT3 (0.71) FLT3RETCSF1RPDGFRBKIT
SCHEMBL13200140 0.86 FLT3 (0.60) FLT3RETCSF1RPDGFRBKIT
SCHEMBL13200087 0.86 FLT3 (0.56) FLT3RETCSF1RPDGFRBKIT
SCHEMBL15426981 0.85 RAB9A (0.57) FLT3RETCSF1RPDGFRBKIT
SCHEMBL13200200 0.85 FLT3 (0.77) FLT3RETCSF1RPDGFRBKIT
SCHEMBL13200052 0.84 FLT3 (0.75) FLT3RETCSF1RPDGFRBKIT
SCHEMBL13200114 0.84 FLT3 (0.58) FLT3RETCSF1RPDGFRBKIT
SCHEMBL13200234 0.83 FLT3 (0.59) FLT3RETCSF1RPDGFRBKIT

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