SCHEMBL16067124

SCHEMBL16067124

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6c6cc7ccccc7n6c5c43)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.33
KDM4E B2RXH2 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KMT2A Q03164 4/20 0.32
MEN1 O00255 3/20 0.32
PDE5A O76074 3/20 0.32
GBA1 P04062 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
MAPT P10636 1/20 0.31
TERT O14746 1/20 0.31
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
ACP1 P24666 2/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL22649070 0.96 ATM (0.33) ATMKDM4EL3MBTL1KMT2AMEN1
SCHEMBL16067195 0.93 GP6 (0.33)
SCHEMBL17033640 0.90 KDM4E (0.33) ATMKDM4EL3MBTL1KMT2AMEN1
SCHEMBL16067143 0.89 ATM (0.36) ATMKDM4EL3MBTL1KMT2AMEN1
SCHEMBL16067144 0.89 L3MBTL1 (0.34) ATMKDM4EL3MBTL1KMT2AMEN1
SCHEMBL16066810 0.88
SCHEMBL16067191 0.88 KDM4E (0.36) ATMKDM4EL3MBTL1KMT2AMEN1
SCHEMBL16067200 0.88 KDM4E (0.32) ATMKDM4EL3MBTL1KMT2AMEN1
SCHEMBL17033702 0.88 MEN1 (0.33) ATMKDM4EL3MBTL1KMT2AMEN1
SCHEMBL16066652 0.86 KDM4E (0.30) ATMKDM4EL3MBTL1GSK3AGSK3B

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-2014142488-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING SAME 주식회사 두산 (KR) 2014-09-18 WO disclosed