SCHEMBL13200081

SCHEMBL13200081

CC(C)(C)c1cc(NC(=O)Cc2ccc(OCCn3ccnc3)cc2)no1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 11/20 0.57
RET P07949 4/20 0.54
MAPK8 P45983 2/20 0.51
MAPK9 P45984 2/20 0.51
MAPK10 P53779 2/20 0.51
FLT3 P36888 1/20 0.49

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
SCHEMBL13234581 0.87 RAF1 (0.62) TBXAS1RETFLT3
SCHEMBL13200102 0.83 RET (0.57) RETFLT3
SCHEMBL13200145 0.81 RAF1 (0.53) RETFLT3
SCHEMBL13200082 0.80 EGFR (0.61) RETFLT3
SCHEMBL13200059 0.80 RET (0.52) RETFLT3
SCHEMBL13200076 0.79 RET (0.49) RETFLT3
SCHEMBL13200112 0.79 ALDH1A1 (0.54) RETFLT3
SCHEMBL13239632 0.78 RAF1 (0.69) RETFLT3
SCHEMBL13199934 0.78 KDM4E (0.71) RETMAPK10FLT3
SCHEMBL13200123 0.77 FLT3 (0.53) RETFLT3

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