SCHEMBL3422839

SCHEMBL3422839

Nc1n[nH]c2cccc(-c3ccc(NC(=O)Nc4ccccc4-c4ccc(F)c(C(F)(F)F)c4)cc3F)c12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.66
FLT3 P36888 14/20 0.66
KIT P10721 12/20 0.66
CSF1R P07333 10/20 0.66
FLT4 P35916 10/20 0.66
LYN P07948 9/20 0.66
FLT1 P17948 9/20 0.66
SRC P12931 8/20 0.66
BLK P51451 8/20 0.66
LCK P06239 8/20 0.66
FYN P06241 6/20 0.66
ABL1 P00519 4/20 0.62
NTRK1 P04629 3/20 0.59
CDK19 Q9BWU1 2/20 0.58
PLK4 O00444 3/20 0.58
AURKA O14965 3/20 0.58
ROCK2 O75116 3/20 0.58
CDK1 P06493 3/20 0.58
MET P08581 3/20 0.58
PRKACA P17612 3/20 0.58

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
SCHEMBL422809 0.90 KDR (0.75) KDRFLT3KITCSF1RFLT4
SCHEMBL3394287 0.87 KDR (0.69) KDRFLT3KITCSF1RFLT4
SCHEMBL421150 0.86 KDR (0.79) KDRFLT3KITCSF1RFLT4
SCHEMBL425326 0.85 KDR (0.75) KDRFLT3KITCSF1RFLT4
SCHEMBL423148 0.84 KDR (0.82) KDRFLT3KITCSF1RFLT4
SCHEMBL420765 0.80 KDR (1.00) KDRFLT3KITCSF1RFLT4
SCHEMBL424290 0.79 KDR (0.78) KDRFLT3KITCSF1RFLT4
SCHEMBL419459 0.79 KDR (1.00) KDRFLT3KITCSF1RFLT4
SCHEMBL425759 0.79 KDR (0.74) KDRFLT3KITCSF1RFLT4
SCHEMBL3422842 0.78 KDR (0.56) KDRFLT3KITCSF1RFLT4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2246333-A1 Indazole, benzisoxazole, and benzisothiazole kinase inhibitors Abbott Laboratories (US) 2010-11-03 EP disclosed