SCHEMBL15801817

SCHEMBL15801817

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c5ccc6c(ccn6-c6ccccc6)c5ccc43)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
PDE5A O76074 1/20 0.30
IL1R1 P14778 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
SCHEMBL16357384 0.95 KDM4E (0.37) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15801880 0.94 KDM4E (0.35) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15632103 0.93 KDM4E (0.37) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15801931 0.92 KDM4E (0.42) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15632143 0.92 KDM4E (0.37) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15801826 0.91 KDM4E (0.41) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15801821 0.88 L3MBTL1 (0.35) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15802272 0.88 KDM4E (0.38) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15801932 0.88 KDM4E (0.35) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15801818 0.88 KDM4E (0.35) KDM4EATML3MBTL1POLBCTDSP1

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-2014092354-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 (KR) 2014-06-19 WO disclosed