SCHEMBL16066443

SCHEMBL16066443

c1cc(-c2ccncc2)cc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n2c3ccccc3cc42)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GRM5 P41594 1/20 0.34
MAPK10 P53779 4/20 0.33
MAPK9 P45984 3/20 0.33
PDE10A Q9Y233 1/20 0.33
DHFR P00374 1/20 0.33
MAPK8 P45983 1/20 0.33
KIF11 P52732 1/20 0.33
MAPT P10636 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HSP90AA1 P07900 1/20 0.32
MKNK1 Q9BUB5 1/20 0.32
GAA P10253 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NOTUM Q6P988 1/20 0.31
IMPDH2 P12268 1/20 0.31
MAPK14 Q16539 1/20 0.31

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
SCHEMBL16067228 1.00 KDM4E (0.35) KDM4EATML3MBTL1GRM5MAPK10
SCHEMBL16066216 0.95 KDM4E (0.36) KDM4EATML3MBTL1GRM5MAPK10
SCHEMBL16066998 0.94 KDM4E (0.36) KDM4EATML3MBTL1GRM5MAPK10
SCHEMBL16067221 0.92 ATM (0.42) KDM4EATML3MBTL1PDE10AMAPT
SCHEMBL16066404 0.92 ATM (0.42) KDM4EATML3MBTL1PDE10AMAPT
SCHEMBL17033529 0.91 KDM4E (0.36) KDM4EATML3MBTL1GRM5MAPK10
SCHEMBL16066442 0.89 CYP11B1 (0.39) KDM4EGRM5DHFRMAPTMEN1
SCHEMBL16067235 0.89 CYP11B1 (0.39) KDM4EGRM5DHFRMAPTMEN1
SCHEMBL16067230 0.88 KDM4E (0.37) KDM4EATML3MBTL1PDE10AMAPT
SCHEMBL16066428 0.88 KDM4E (0.37) KDM4EATML3MBTL1PDE10AMAPT

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
WO-2014142488-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING SAME 주식회사 두산 (KR) 2014-09-18 WO disclosed