SCHEMBL17999957

SCHEMBL17999957

c1ccc(N(c2ccc3c(c2)Oc2cccc4c(N(c5ccccc5)c5cccnc5)ccc-3c24)c2ccc3ccc4ccccc4c3c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.32
POLB P06746 2/20 0.32
MAPT P10636 2/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
ALDH1A1 P00352 2/20 0.31
CYP11B1 P15538 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
LMNA P02545 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
SCHEMBL17999926 0.93 MEN1 (0.32) KDM4ESMN1; SMN2MAPK1ATMNPC1
SCHEMBL17999932 0.93 MEN1 (0.32) KDM4ESMN1; SMN2MAPK1ATMNPC1
SCHEMBL17999942 0.91 KDM4E (0.38) KDM4EHSD17B10MAPK1ATMALDH1A1
SCHEMBL17999914 0.91 KDM4E (0.38) KDM4EHSD17B10MAPK1ATMALDH1A1
SCHEMBL16282081 0.84 KDM4E (0.38) KDM4EPOLBMAPK1ATM
SCHEMBL17999909 0.84 KDM4E (0.38) KDM4EPOLBMAPK1ATM
SCHEMBL16282049 0.84 KDM4E (0.38) KDM4EPOLBMAPK1ATM
SCHEMBL16282051 0.84 KDM4E (0.37) KDM4EPOLBMAPTTDP1MAPK1
SCHEMBL20151726 0.83 KDM4E (0.39) KDM4EPOLBMAPK1ATM
SCHEMBL17702133 0.81 CYP11B1 (0.34) KDM4EMAPTHPGDSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160233428-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-11 US disclosed
US-20160233428-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-11 US disclosed