SCHEMBL15801824

SCHEMBL15801824

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c6ccc7c(ccn7-c7ccccc7)c6ccc54)c3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPT P10636 3/20 0.35
HPGD P15428 3/20 0.35
LMNA P02545 2/20 0.35
CYP19A1 P11511 2/20 0.32
POLB P06746 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
CYP17A1 P05093 1/20 0.32
CYP11B1 P15538 1/20 0.32
NTSR1 P30989 1/20 0.32
RXFP1 Q9HBX9 1/20 0.31
GLA P06280 1/20 0.31
SCN9A Q15858 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
SCHEMBL15801935 0.98 KDM4E (0.34) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL15801839 0.95 MEN1 (0.34) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL15801849 0.92 KDM4E (0.35) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL15801908 0.92 KDM4E (0.34) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL15801932 0.92 KDM4E (0.35) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15801838 0.92 KDM4E (0.38) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL15801930 0.92 KDM4E (0.38) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL15801825 0.92 KDM4E (0.35) KDM4EATML3MBTL1POLBCTDSP1
SCHEMBL15801819 0.91 KDM4E (0.38) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL15801885 0.90 GRM5 (0.35) KDM4EATML3MBTL1KMT2AMAPT

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