SCHEMBL13200230

SCHEMBL13200230

Cn1nc(C(C)(C)C)cc1C(=O)Nc1ccc(CC(=O)Nc2cc(C(C)(C)C)on2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 6/20 0.57
RET P07949 8/20 0.53
NTRK1 P04629 3/20 0.49
CSF1R P07333 3/20 0.49
KDR P35968 1/20 0.49
KCNH2 Q12809 1/20 0.49
CCDC6 Q16204 1/20 0.49
ROCK1 Q13464 1/20 0.48
MAPT P10636 1/20 0.48
MAPK1 P28482 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
RAF1 P04049 1/20 0.48
GALR3 O60755 1/20 0.47
RAB9A P51151 1/20 0.47
EGFR P00533 1/20 0.46

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
SCHEMBL13234678 0.87 FLT3 (0.62) FLT3RETCSF1RRAF1RAB9A
SCHEMBL13200615 0.81 FLT3 (0.62) FLT3RETNTRK1CSF1RRAF1
SCHEMBL13200187 0.80 FLT3 (0.54) FLT3RETNTRK1CSF1RROCK1
SCHEMBL13200037 0.79 FLT3 (0.73) FLT3RETNTRK1ROCK1RAF1
SCHEMBL4425426 0.79 NPSR1 (0.59) MAPTMAPK1NPSR1GALR3RAB9A
SCHEMBL13200041 0.79 FLT3 (0.62) FLT3RETNTRK1ROCK1RAF1
SCHEMBL13199933 0.78 GAPDH (0.71) FLT3RETNTRK1ROCK1RAF1
SCHEMBL13200277 0.78 LMNA (0.56) FLT3RETNTRK1CSF1RROCK1
SCHEMBL13200061 0.78 FLT3 (0.61) FLT3RETNTRK1MAPK1RAF1
SCHEMBL13200153 0.77 FLT3 (0.58) FLT3RETNTRK1CSF1RROCK1

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