SCHEMBL16409641

SCHEMBL16409641

c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc(-n5c6ccccc6c6ccccc65)cc43)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
ATM Q13315 1/20 0.41
MAPT P10636 3/20 0.36
MAPK1 P28482 2/20 0.36
HPGD P15428 2/20 0.36
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
TSHR P16473 3/20 0.35
HSD17B10 Q99714 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ACHE P22303 1/20 0.35
CYP19A1 P11511 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
DHODH Q02127 1/20 0.34
AHR P35869 1/20 0.34
LMNA P02545 2/20 0.33
ADORA3 P0DMS8 1/20 0.33
ADORA2B P29275 1/20 0.33

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
SCHEMBL16409608 1.00 KDM4E (0.41) KDM4EL3MBTL1ATMMAPTMAPK1
SCHEMBL14748555 0.92 KDM4E (0.42) KDM4EL3MBTL1ATMMAPTMAPK1
SCHEMBL14748535 0.92 KDM4E (0.42) KDM4EL3MBTL1ATMMAPTMAPK1
SCHEMBL15371682 0.92 KDM4E (0.41) KDM4EL3MBTL1ATMMAPTMAPK1
SCHEMBL12031621 0.92 KDM4E (0.47) KDM4EL3MBTL1ATMMAPTMAPK1
SCHEMBL25000910 0.92 L3MBTL1 (0.46) KDM4EL3MBTL1ATMMAPTMAPK1
SCHEMBL14748536 0.91 KDM4E (0.36) KDM4EL3MBTL1ATMMAPTMAPK1
SCHEMBL8817110 0.90 KDM4E (0.41) KDM4EL3MBTL1ATMMAPTMAPK1
SCHEMBL14748524 0.90 KDM4E (0.41) KDM4EL3MBTL1ATMMAPTMAPK1
SCHEMBL15275598 0.90 KDM4E (0.33) KDM4EL3MBTL1ATMMAPTMAPK1

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-2015009102-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 주식회사 두산 (KR) 2015-01-22 WO disclosed