SCHEMBL13200004

SCHEMBL13200004

CC(C)(C)OC(=O)Nc1ccc(CC(=O)Nc2cc(C(C)(C)C)on2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 1/20 0.64
▸ RET P07949 7/20 0.56
▸ NTRK1 P04629 1/20 0.55
▸ RAF1 P04049 3/20 0.54
▸ ROCK1 Q13464 1/20 0.53
▸ EGFR P00533 1/20 0.53
▸ HDAC3 O15379 1/20 0.53
▸ HDAC1 Q13547 1/20 0.53
▸ HDAC2 Q92769 1/20 0.53
▸ HDAC8 Q9BY41 1/20 0.53
▸ MAPK14 Q16539 2/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ GLS O94925 1/20 0.49
▸ MAPK13 O15264 1/20 0.49
▸ MAPK12 P53778 1/20 0.49
▸ MAPK11 Q15759 1/20 0.49
▸ KDR P35968 1/20 0.48

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
SCHEMBL13234784 0.84 MAPK14 (0.70) FLT3RAF1MAPK14MEN1NPC1
SCHEMBL13200780 0.82 FLT3 (0.63) FLT3RETNTRK1RAF1ROCK1
SCHEMBL13199933 0.82 GAPDH (0.71) FLT3RETNTRK1RAF1ROCK1
SCHEMBL16943756 0.81 EGFR (0.59) RAF1EGFRMAPK14MEN1NPC1
SCHEMBL13199934 0.81 KDM4E (0.71) FLT3RETNTRK1RAF1ROCK1
SCHEMBL13200037 0.81 FLT3 (0.73) FLT3RETNTRK1RAF1ROCK1
SCHEMBL9978507 0.81 FLT3 (0.62) FLT3RETNTRK1RAF1ROCK1
SCHEMBL1256800 0.81 FLT3 (0.62) FLT3RETNTRK1RAF1ROCK1
SCHEMBL13200131 0.81 FLT3 (0.60) FLT3RETNTRK1RAF1ROCK1
SCHEMBL13200041 0.80 FLT3 (0.62) FLT3RETNTRK1RAF1ROCK1

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
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