SCHEMBL16282149

SCHEMBL16282149

c1ccc2cc(N(c3ccc4c(c3)Oc3cccc5c(N(c6ccc7ccccc7c6)c6ccc7oc8ccccc8c7c6)ccc-4c35)c3ccc4oc5ccccc5c4c3)ccc2c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
MAPK1 P28482 1/20 0.35
ATM Q13315 1/20 0.35
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL16282168 0.94 KDM4E (0.31) KDM4EMAPK1ATM
SCHEMBL17999939 0.90 KDM4E (0.33) KDM4EMAPK1ATMMEN1NPC1
SCHEMBL17999910 0.90 KDM4E (0.33) KDM4EMAPK1ATMMEN1NPC1
SCHEMBL16282196 0.90 KDM4E (0.33) KDM4EMAPK1ATMMEN1NPC1
SCHEMBL16282195 0.89 KDM4E (0.33) KDM4EMAPK1ATMNPC1RAB9A
SCHEMBL16282049 0.88 KDM4E (0.38) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL16282081 0.88 KDM4E (0.38) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL17999909 0.88 KDM4E (0.38) KDM4EMAPK1ATMMEN1KMT2A
SCHEMBL18021799 0.88 KDM4E (0.40) KDM4EMAPK1ATMMEN1NPC1
SCHEMBL16282158 0.88 KDM4E (0.32) KDM4EMEN1NPC1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9425416-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-23 US disclosed
US-9425416-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-23 US disclosed
US-20140361266-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-12-11 US disclosed
US-20140361266-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-12-11 US disclosed