SCHEMBL16749665

SCHEMBL16749665

c1ccc(N(c2ccccc2-c2ccccc2-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2cccc3ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PTGER4 P35408 1/20 0.34
TSPO P30536 2/20 0.34
SIGMAR1 Q99720 2/20 0.31
TLR4 O00206 1/20 0.31
PTGES O14684 1/20 0.31
MCL1 Q07820 1/20 0.30
ACMSD Q8TDX5 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL17040884 0.93 KDM4E (0.40) KDM4EATML3MBTL1SIGMAR1MCL1
SCHEMBL16749726 0.92 KDM4E (0.41) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL16749664 0.92 KDM4E (0.37) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL13803334 0.91 L3MBTL1 (0.40) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL16749685 0.91 L3MBTL1 (0.40) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL16749671 0.91 L3MBTL1 (0.46) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL13803828 0.90 KDM4E (0.39) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL16749672 0.90 POLB (0.34) TSPOSIGMAR1PTGESMCL1ACMSD
SCHEMBL13803466 0.90 L3MBTL1 (0.41) KDM4EATML3MBTL1PTGER4TSPO
SCHEMBL13803355 0.90 KDM4E (0.41) KDM4EATML3MBTL1PTGER4TSPO

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-2015076523-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREFOR 덕산네오룩스 주식회사 2015-05-28 WO disclosed