SCHEMBL14979567

SCHEMBL14979567

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccc(-c6cc7c(c8ccccc68)c6ccccc6n7-c6ccccc6)cc5c5c6ccccc6ccc54)c3)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
ATM Q13315 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
PTGER4 P35408 1/20 0.31
PTGES O14684 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
JAK2 O60674 1/20 0.31
JAK3 P52333 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
NFKB1 P19838 1/20 0.30
MAPK1 P28482 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL14979580 0.98 KDM4E (0.33) KDM4EATML3MBTL1PTGER4PTGES
SCHEMBL14979582 0.95 KDM4E (0.37) KDM4EATML3MBTL1PTGER4PTGES
SCHEMBL14979520 0.94 KDM4E (0.36) KDM4EATML3MBTL1PTGER4PTGES
SCHEMBL14979519 0.94 KDM4E (0.36) KDM4EATML3MBTL1PTGER4PTGES
SCHEMBL14979594 0.93 KDM4E (0.35) KDM4EATML3MBTL1PTGER4PTGES
SCHEMBL14979559 0.92 KDM4E (0.35) KDM4EATML3MBTL1PTGER4PTGES
SCHEMBL24151817 0.90 KDM4E (0.42) KDM4EATML3MBTL1PTGER4PTGES
SCHEMBL14979568 0.90 KDM4E (0.32) KDM4EATML3MBTL1PTGES
SCHEMBL14979579 0.90 KDM4E (0.30) KDM4EATML3MBTL1
SCHEMBL22479975 0.89 KDM4E (0.41) KDM4EATML3MBTL1PTGER4PTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140323723-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND AN ORGANIC ELECTROLUMINESCENT DEVICE USINC THE SAME ROHM & HAAS ELECT MAT (KR) 2014-10-30 US disclosed
US-20140323723-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND AN ORGANIC ELECTROLUMINESCENT DEVICE USINC THE SAME ROHM & HAAS ELECT MAT (KR) 2014-10-30 US disclosed
WO-2013073874-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND AN ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2013-05-23 WO disclosed