SCHEMBL580304

SCHEMBL580304

CNc1nccc(-c2cccnc2Oc2ccc(N3C=Cc4ccccc4C3N)cc2C)n1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TEK Q02763 13/20 0.52
KDR P35968 10/20 0.52
AURKB Q96GD4 12/20 0.48
AURKA O14965 10/20 0.48
TPX2 Q9ULW0 6/20 0.48
LCK P06239 5/20 0.45
ABL1 P00519 1/20 0.45
CSF1R P07333 1/20 0.45
KIT P10721 1/20 0.45
SRC P12931 1/20 0.45
MAPK14 Q16539 1/20 0.45

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
SCHEMBL580587 0.77 TEK (0.44) TEKKDRAURKBAURKATPX2
SCHEMBL1264679 0.75 TEK (0.64) TEKKDRAURKBAURKATPX2
SCHEMBL4767675 0.74 TEK (0.42) TEKKDRAURKBAURKATPX2
SCHEMBL580441 0.73 TEK (0.45) TEKKDRAURKBAURKATPX2
SCHEMBL1265828 0.72 TEK (0.56) TEKKDRAURKBAURKATPX2
SCHEMBL580771 0.72 TEK (0.46) TEKKDRAURKBAURKATPX2
SCHEMBL581733 0.72 AURKB (0.51) TEKKDRAURKBAURKATPX2
SCHEMBL580453 0.71 TEK (0.47) TEKKDRAURKBAURKATPX2
SCHEMBL5262625 0.71 TEK (0.61) TEKKDRAURKBAURKATPX2
SCHEMBL5259299 0.70 TEK (0.79) TEKKDRAURKBAURKATPX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1984353-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2015-12-30 EP disclosed
EP-2418209-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2014-06-25 EP disclosed
EP-2418209-A1 Aurora kinase modulators and method of use Amgen Inc. (US) 2012-02-15 EP disclosed