SCHEMBL17033601

SCHEMBL17033601

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc6cc7c8ccccc8c8ccccc8n7c6c54)c3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
ABCG2 Q9UNQ0 4/20 0.32
TSHR P16473 2/20 0.32
PDE10A Q9Y233 1/20 0.31
HSD17B10 Q99714 2/20 0.30
MAPT P10636 1/20 0.30
PLA2G10 O15496 2/20 0.30
PDE5A O76074 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL17033660 0.98 KDM4E (0.34) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033605 0.95 PDE10A (0.34) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033603 0.93 KMT2A (0.36) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL16067191 0.91 KDM4E (0.36) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033656 0.91 ATM (0.37) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033622 0.90 ATM (0.39) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033645 0.90 KDM4E (0.33) KDM4EATML3MBTL1KMT2A
SCHEMBL17033625 0.89 ATM (0.36) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL19652297 0.89 L3MBTL1 (0.44) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL16067212 0.89 KDM4E (0.34) 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