SCHEMBL974146

SCHEMBL974146

CNc1nccc(-c2cccnc2Oc2ccc(Nc3nc4c(F)c(F)ccc4[nH]3)cc2OC)n1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TEK Q02763 13/20 0.62
KDR P35968 9/20 0.59
PDE10A Q9Y233 1/20 0.58
AURKB Q96GD4 11/20 0.51
AURKA O14965 8/20 0.51
LCK P06239 5/20 0.51
TPX2 Q9ULW0 4/20 0.46
ABL1 P00519 1/20 0.44
CSF1R P07333 1/20 0.44
KIT P10721 1/20 0.44
SRC P12931 1/20 0.44
MAPK14 Q16539 1/20 0.44

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
SCHEMBL973160 0.92 TEK (0.73) TEKKDRPDE10AAURKBAURKA
SCHEMBL974952 0.91 TEK (0.62) TEKKDRPDE10AAURKBAURKA
SCHEMBL974173 0.88 PDE10A (0.72) TEKKDRPDE10AAURKBAURKA
SCHEMBL974060 0.84 TEK (0.82) TEKKDRAURKBAURKALCK
SCHEMBL972867 0.83 TEK (0.77) TEKKDRAURKBAURKALCK
SCHEMBL974111 0.82 TEK (0.63) TEKKDRPDE10AAURKBAURKA
SCHEMBL973068 0.80 TEK (0.70) TEKKDRPDE10AAURKBAURKA
SCHEMBL973155 0.80 TEK (0.81) TEKKDRAURKBAURKALCK
SCHEMBL973142 0.80 TEK (0.80) TEKKDRAURKBAURKALCK
SCHEMBL974106 0.79 TEK (0.81) TEKKDRAURKBAURKALCK

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
US-7868177-B2 Multi-cyclic compounds and method of use AMGEN INC. (US) 2011-01-11 US claimed
EP-1994030-B1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE AMGEN INC (US) 2010-08-25 EP claimed
EP-1994030-B1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE AMGEN INC (US) 2010-08-25 EP disclosed