SCHEMBL17033629

SCHEMBL17033629

c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc5cc6c7ccccc7c7ccccc7n6c5cc43)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ATM Q13315 1/20 0.41
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KMT2A Q03164 2/20 0.33
HTR6 P50406 2/20 0.33
NPY5R Q15761 1/20 0.32
TSPO P30536 1/20 0.31
HDAC4 P56524 1/20 0.31
IL1R1 P14778 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
RAC2 P15153 1/20 0.30
RAC3 P60763 1/20 0.30
CDC42 P60953 1/20 0.30
RAC1 P63000 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
SCHEMBL17033462 0.96 KDM4E (0.42) KDM4EL3MBTL1ATMTSHRHSD17B10
SCHEMBL17033632 0.91 ATM (0.44) KDM4EL3MBTL1ATMTSHRHSD17B10
SCHEMBL16067010 0.89 L3MBTL1 (0.41) KDM4EL3MBTL1ATMTSHRKMT2A
SCHEMBL16066188 0.88 L3MBTL1 (0.42) KDM4EL3MBTL1ATMTSHRKMT2A
SCHEMBL17033425 0.87 KDM4E (0.56) KDM4EL3MBTL1ATMTSHRKMT2A
SCHEMBL17033469 0.86 ATM (0.45) KDM4EL3MBTL1ATMTSHRHSD17B10
SCHEMBL17033610 0.86 CHRNB4 (0.39) KDM4EL3MBTL1ATMTSHRHSD17B10
SCHEMBL17033615 0.86 KDM4E (0.37) KDM4EL3MBTL1ATMTSHRHSD17B10
SCHEMBL17989591 0.86 L3MBTL1 (0.48) KDM4EL3MBTL1ATMTSHRHSD17B10
SCHEMBL16066386 0.85 KDM4E (0.40) KDM4EL3MBTL1ATMTSHRHSD17B10

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