SCHEMBL17033443

SCHEMBL17033443

c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4ccc5c(cc6c7ccccc7c7ccccc7n65)c43)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
KMT2A Q03164 2/20 0.34
IL1R1 P14778 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL17033893 0.92 KDM4E (0.33) L3MBTL1KDM4EATM
SCHEMBL17033426 0.90 ATM (0.41) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL17033446 0.86 CHRNB4 (0.37) L3MBTL1KDM4EATMKMT2A
SCHEMBL17990410 0.85 L3MBTL1 (0.55) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL17245350 0.85 L3MBTL1 (0.48) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL17033385 0.84 KDM4E (0.34) L3MBTL1KDM4EATMKMT2AMEN1
SCHEMBL17033595 0.84 KDM4E (0.37) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL17033816 0.83 L3MBTL1 (0.42) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL17033438 0.83 L3MBTL1 (0.37) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL17033917 0.83 CYP19A1 (0.43) KDM4EMAPTHTT

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