SCHEMBL14449488

SCHEMBL14449488

C=NN(C)/C(=N\N)c1cc(CN2CCN(C(=O)c3cccc(Cl)c3F)CC2)nc(Nc2nccs2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 18/20 0.48
AURKB Q96GD4 11/20 0.38
INCENP Q9NQS7 5/20 0.38
PLK4 O00444 1/20 0.37
JAK2 O60674 1/20 0.37
STK10 O94804 1/20 0.37
ABL1 P00519 1/20 0.37
RET P07949 1/20 0.37
BCR P11274 1/20 0.37
FER P16591 1/20 0.37
EPHA2 P29317 1/20 0.37
ACVR1B P36896 1/20 0.37
TGFBR1 P36897 1/20 0.37
TEC P42680 1/20 0.37
ABL2 P42684 1/20 0.37
FRK P42685 1/20 0.37
MAPK8 P45983 1/20 0.37
IRAK1 P51617 1/20 0.37
LIMK1 P53667 1/20 0.37
MAPK10 P53779 1/20 0.37

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
SCHEMBL3533403 0.88 AURKA (0.53) AURKAAURKBINCENPPLK4JAK2
SCHEMBL27718203 0.87 AURKA (0.57) AURKAAURKBINCENPPLK4JAK2
SCHEMBL3531952 0.86 AURKA (0.55) AURKAAURKBINCENPPLK4JAK2
SCHEMBL3525938 0.85 AURKA (0.53) AURKAAURKBINCENPPLK4JAK2
SCHEMBL27697791 0.85 AURKA (0.53) AURKAAURKBINCENPPLK4JAK2
SCHEMBL13031003 0.85 AURKA (0.55) AURKAAURKBINCENPPLK4JAK2
SCHEMBL3529430 0.84 AURKA (0.55) AURKAAURKBINCENPPLK4JAK2
Trifluoroacetic Acid SCHEMBL3530547 0.84 AURKA (0.49) AURKAAURKBINCENPPLK4JAK2
Trifluoroacetic Acid SCHEMBL3529240 0.83 AURKA (0.52) AURKAAURKBINCENPPLK4JAK2
Trifluoroacetic Acid SCHEMBL3531412 0.83 AURKA (0.52) AURKAAURKBINCENPPLK4JAK2

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-1813609-A2 NOVEL AMINOPYRIDINE DERIVATIVES HAVING SELECTIVE AURORA-A INHIBITORY EFFECT BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-01 EP disclosed