SCHEMBL15801826

SCHEMBL15801826

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-n5c6ccccc6c6c7ccc8c(ccn8-c8ccccc8)c7ccc65)cc4)cc3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ATM Q13315 1/20 0.41
HTR7 P34969 1/20 0.34
HDAC4 P56524 1/20 0.34
POLB P06746 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 2/20 0.33
PTK2B Q14289 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
AVPR1A P37288 1/20 0.32
ALDH1A1 P00352 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
IL1R1 P14778 1/20 0.32
MGLL Q99685 1/20 0.31
MEN1 O00255 1/20 0.31
HTT P42858 1/20 0.31
ABCG2 Q9UNQ0 1/20 0.31

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
SCHEMBL15801931 0.99 KDM4E (0.42) KDM4EL3MBTL1ATMHTR7HDAC4
SCHEMBL15801937 0.95 KDM4E (0.37) KDM4EL3MBTL1ATMHTR7HDAC4
SCHEMBL20426192 0.94 KDM4E (0.42) KDM4EL3MBTL1ATMHTR7POLB
SCHEMBL15801819 0.94 KDM4E (0.38) KDM4EL3MBTL1ATMHTR7HDAC4
SCHEMBL15802149 0.93 L3MBTL1 (0.47) KDM4EL3MBTL1ATMHTR7HDAC4
SCHEMBL15801930 0.92 KDM4E (0.38) KDM4EL3MBTL1ATMPOLBCTDSP1
SCHEMBL15801838 0.92 KDM4E (0.38) KDM4EL3MBTL1ATMPOLBCTDSP1
SCHEMBL15801817 0.91 KDM4E (0.36) KDM4EL3MBTL1ATMPOLBCTDSP1
SCHEMBL15802180 0.90 NPC1 (0.38) KDM4EL3MBTL1ATMHTR7HDAC4
SCHEMBL15801818 0.90 KDM4E (0.35) KDM4EL3MBTL1ATMPOLBCTDSP1

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