SCHEMBL4668233

SCHEMBL4668233

CSc1nccc(-c2cccnc2Oc2ccc(N3N=C(c4ccccc4)c4ccccc4C3N)cc2)n1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AURKA O14965 3/20 0.37
AURKB Q96GD4 3/20 0.37
TPX2 Q9ULW0 3/20 0.37
MAPK13 O15264 1/20 0.34
MAPK12 P53778 1/20 0.34
MAPK11 Q15759 1/20 0.34
MAPK14 Q16539 1/20 0.34
PDE10A Q9Y233 4/20 0.33
TEK Q02763 1/20 0.33
CSNK1E P49674 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL4668332 0.85 AURKB (0.36) AURKAAURKBTPX2PDE10ATEK
SCHEMBL4668256 0.80 AURKA (0.38) AURKAAURKBTPX2MAPK13MAPK12
SCHEMBL4667173 0.79 AURKB (0.46) AURKAAURKBTPX2TEK
SCHEMBL4667140 0.79 PDE10A (0.43) PDE10ATEK
SCHEMBL4668267 0.77 TEK (0.46) AURKAAURKBTPX2TEK
SCHEMBL580553 0.76 LTA4H (0.36) AURKAAURKBMAPK14
SCHEMBL581299 0.74 TEK (0.42) AURKAAURKBTPX2MAPK14TEK
SCHEMBL581233 0.74 AURKB (0.41) AURKAAURKBTPX2MAPK14PDE10A
SCHEMBL4668273 0.73 AURKB (0.48) AURKAAURKBTPX2TEK
SCHEMBL4668531 0.71 TEK (0.41) AURKAAURKBTPX2TEK

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
EP-1984353-A1 AURORA KINASE MODULATORS AND METHOD OF USE Amgen, Inc (US) 2008-10-29 EP disclosed
WO-2007087276-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2007-08-02 WO disclosed