SCHEMBL17033448

SCHEMBL17033448

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc(-n5c6ccccc6c6ccc7c(cc8c9ccccc9c9ccccc9n87)c65)c4)cc3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
ATM Q13315 2/20 0.35
PDE10A Q9Y233 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KMT2A Q03164 5/20 0.33
MEN1 O00255 4/20 0.33
GAA P10253 2/20 0.33
NR3C1 P04150 1/20 0.32
ABCG2 Q9UNQ0 4/20 0.31
ALDH1A1 P00352 3/20 0.31
LMNA P02545 2/20 0.31
TSHR P16473 1/20 0.31
PTGER4 P35408 1/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
GLA P06280 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
SCHEMBL17033743 0.97 PTGER4 (0.33) KDM4EATMPDE10AL3MBTL1KMT2A
SCHEMBL17033459 0.95 KDM4E (0.35) KDM4EATMPDE10AL3MBTL1KMT2A
SCHEMBL17033454 0.95 KDM4E (0.36) KDM4EATMPDE10AL3MBTL1KMT2A
SCHEMBL17033747 0.94 KDM4E (0.38) KDM4EATMPDE10AL3MBTL1KMT2A
SCHEMBL17033441 0.92 KDM4E (0.34) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033438 0.92 L3MBTL1 (0.37) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033426 0.92 ATM (0.41) KDM4EATMPDE10AL3MBTL1KMT2A
SCHEMBL17033757 0.91 KDM4E (0.36) KDM4EATMPDE10AL3MBTL1KMT2A
SCHEMBL17033449 0.91 KDM4E (0.38) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033725 0.91 MEN1 (0.34) KDM4EATMPDE10AL3MBTL1KMT2A

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