SCHEMBL16660265

SCHEMBL16660265

CC(=O)c1cc(Nc2cc(C)[nH]n2)nc(/C=C/c2ccccc2)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 9/20 0.59
AURKA O14965 8/20 0.59
RET P07949 4/20 0.59
SRC P12931 3/20 0.59
PLK4 O00444 2/20 0.59
ABL1 P00519 2/20 0.59
NTRK1 P04629 2/20 0.59
LCK P06239 2/20 0.59
CSF1R P07333 2/20 0.59
KIT P10721 2/20 0.59
FGFR1 P11362 2/20 0.59
PDGFRA P16234 2/20 0.59
TYK2 P29597 2/20 0.59
KDR P35968 2/20 0.59
FLT3 P36888 2/20 0.59
PTK2 Q05397 2/20 0.59
MAP4K5 Q9Y4K4 2/20 0.59
ITK Q08881 2/20 0.59
GSK3B P49841 2/20 0.59
CHEK1 O14757 1/20 0.59

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
SCHEMBL10122874 0.83 AURKA (0.66) AURKBAURKARETSRCPLK4
SCHEMBL10122920 0.82 AURKA (0.65) AURKBAURKARETSRCPLK4
SCHEMBL14546310 0.82 AURKA (0.53) AURKBAURKARETSRCPLK4
SCHEMBL13675323 0.81 AURKA (0.64) AURKBAURKARETSRCPLK4
SCHEMBL10123180 0.81 AURKA (0.64) AURKBAURKARETSRCPLK4
SCHEMBL10122950 0.81 AURKA (0.62) AURKBAURKARETSRCPLK4
SCHEMBL10122961 0.80 AURKA (0.62) AURKBAURKARETSRCPLK4
SCHEMBL10122947 0.80 AURKA (0.61) AURKBAURKARETSRCPLK4
SCHEMBL10122904 0.80 AURKA (0.61) AURKBAURKARETSRCPLK4
SCHEMBL10122942 0.79 AURKA (0.78) AURKBAURKARETSRCPLK4

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-1928456-B1 SUBSTITUTED PYRAZOLE COMPOUNDS MIIKANA THERAPEUTICS INC (US) 2015-04-22 EP disclosed