SCHEMBL17033749

SCHEMBL17033749

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5c5ccc6c(cc7c8ccccc8c8ccccc8n76)c54)c3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTGER4 P35408 1/20 0.34
KMT2A Q03164 6/20 0.33
MEN1 O00255 5/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
HPGD P15428 3/20 0.33
LMNA P02545 2/20 0.33
NTSR1 P30989 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.30
PDE10A Q9Y233 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
SCHEMBL17033725 0.97 MEN1 (0.34) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL17033747 0.94 KDM4E (0.38) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL17033435 0.94 KMT2A (0.37) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033743 0.91 PTGER4 (0.33) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL17033727 0.90 HTR1A (0.35) KDM4EKMT2AMEN1ALDH1A1MAPT
SCHEMBL16675129 0.90 KDM4E (0.40) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL17033757 0.88 KDM4E (0.36) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL17033459 0.87 KDM4E (0.35) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033448 0.87 KDM4E (0.35) KDM4EATML3MBTL1PTGER4KMT2A
SCHEMBL17033454 0.87 KDM4E (0.36) KDM4EATML3MBTL1KMT2AMEN1

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-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 WO disclosed