SCHEMBL2565732

SCHEMBL2565732

CC(C)Oc1cc(Nc2nc(NC(C)c3ccc(F)cc3)c(CN)cc2F)n[nH]1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 4/20 0.53
JAK3 P52333 4/20 0.53
LIMK1 P53667 1/20 0.53
LIMK2 P53671 1/20 0.53
NTRK1 P04629 9/20 0.48
GRK6 P43250 7/20 0.43
AURKA O14965 2/20 0.43
MUSK O15146 1/20 0.40
LCK P06239 1/20 0.40
RET P07949 1/20 0.40
FGFR3 P22607 1/20 0.40
CCNE1 P24864 1/20 0.40
CDK2 P24941 1/20 0.40
FLT3 P36888 1/20 0.40
PTK2B Q14289 1/20 0.40

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
SCHEMBL2565727 1.00 JAK2 (0.53) JAK2JAK3LIMK1LIMK2NTRK1
SCHEMBL2561629 0.89 JAK2 (0.42) JAK2JAK3LIMK1LIMK2NTRK1
SCHEMBL2561614 0.89 JAK2 (0.42) JAK2JAK3LIMK1LIMK2NTRK1
SCHEMBL2578945 0.86 JAK2 (0.51) JAK2JAK3LIMK1LIMK2NTRK1
SCHEMBL2567182 0.86 NTRK1 (0.57) JAK2JAK3LIMK1LIMK2NTRK1
SCHEMBL2578947 0.86 JAK2 (0.51) JAK2JAK3LIMK1LIMK2NTRK1
SCHEMBL2567176 0.86 NTRK1 (0.57) JAK2JAK3LIMK1LIMK2NTRK1
SCHEMBL2486709 0.84 JAK3 (0.75) JAK2JAK3LIMK1LIMK2NTRK1
SCHEMBL2486710 0.84 JAK3 (0.75) JAK2JAK3LIMK1LIMK2NTRK1
SCHEMBL2577239 0.83 JAK2 (0.52) JAK2JAK3LIMK1LIMK2NTRK1

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-2383268-A1 Pyrazolylaminopyridine derivatives useful as kinase inhibitors AstraZeneca AB (SE) 2011-11-02 EP disclosed