SCHEMBL16749685

SCHEMBL16749685

c1ccc(N(c2cccc(-c3ccccc3-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c2)c2cccc3ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
PTGER4 P35408 1/20 0.34
TSPO P30536 2/20 0.33
MCL1 Q07820 1/20 0.33
ACMSD Q8TDX5 1/20 0.33
NPY5R Q15761 1/20 0.32
KMT2A Q03164 2/20 0.31
SIGMAR1 Q99720 2/20 0.31
IL1R1 P14778 1/20 0.31
PTGES O14684 1/20 0.31
MAPT P10636 2/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 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
SCHEMBL16749726 0.94 KDM4E (0.41) L3MBTL1KDM4EATMPTGER4TSPO
SCHEMBL17194674 0.94 L3MBTL1 (0.43) L3MBTL1KDM4EATMPTGER4TSPO
SCHEMBL16749730 0.94 KDM4E (0.37) L3MBTL1KDM4EATMPTGER4MCL1
SCHEMBL18561175 0.93 L3MBTL1 (0.40) L3MBTL1KDM4EATMMCL1ACMSD
SCHEMBL25580871 0.93 KDM4E (0.36) L3MBTL1KDM4EATMPTGER4TSPO
SCHEMBL13803256 0.93 KDM4E (0.38) L3MBTL1KDM4EATMPTGER4TSPO
SCHEMBL16731242 0.93 TSPO (0.34) L3MBTL1KDM4EATMTSPOMCL1
SCHEMBL19151943 0.92 L3MBTL1 (0.41) L3MBTL1KDM4EATMPTGER4TSPO
SCHEMBL13803330 0.92 L3MBTL1 (0.41) L3MBTL1KDM4EATMPTGER4TSPO
SCHEMBL25580578 0.92 KDM4E (0.35) L3MBTL1KDM4EATMPTGER4TSPO

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