SCHEMBL17033462

SCHEMBL17033462

c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc5c(cc43)cc3c4ccccc4c4ccccc4n53)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ATM Q13315 1/20 0.42
KMT2A Q03164 2/20 0.34
HTR6 P50406 2/20 0.33
NPY5R Q15761 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TSPO P30536 1/20 0.32
HDAC4 P56524 1/20 0.32
IL1R1 P14778 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
RAC2 P15153 1/20 0.30
RAC3 P60763 1/20 0.30
CDC42 P60953 1/20 0.30
RAC1 P63000 1/20 0.30
HPGD P15428 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
SCHEMBL17033629 0.96 KDM4E (0.41) KDM4EL3MBTL1ATMKMT2AHTR6
SCHEMBL16066188 0.92 L3MBTL1 (0.42) KDM4EL3MBTL1ATMKMT2AHTR6
SCHEMBL17033469 0.90 ATM (0.45) KDM4EL3MBTL1ATMKMT2ANPY5R
SCHEMBL16066386 0.89 KDM4E (0.40) KDM4EL3MBTL1ATMKMT2AHTR6
SCHEMBL16067217 0.89 KDM4E (0.40) KDM4EL3MBTL1ATMKMT2AHTR6
SCHEMBL16067010 0.88 L3MBTL1 (0.41) KDM4EL3MBTL1ATMKMT2AHTR6
SCHEMBL17019447 0.87 L3MBTL1 (0.55) KDM4EL3MBTL1ATMKMT2AHTR6
SCHEMBL17033632 0.86 ATM (0.44) KDM4EL3MBTL1ATMKMT2ANPY5R
SCHEMBL17033465 0.86 CHRNB4 (0.40) KDM4EL3MBTL1ATMKMT2ANPY5R
SCHEMBL17033463 0.85 KDM4E (0.38) KDM4EL3MBTL1ATMKMT2ANPY5R

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