SCHEMBL17033909

SCHEMBL17033909

c1ccc(-c2ncnc(-c3cccc(-n4c5ccccc5c5ccc6c(cc7c8ccccc8c8ccccc8n76)c54)c3)n2)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
GAA P10253 1/20 0.32
IL1R1 P14778 1/20 0.30
TSHR P16473 1/20 0.30
PDE10A Q9Y233 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 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
SCHEMBL17033454 0.93 KDM4E (0.36) L3MBTL1KDM4EATMKMT2AMEN1
SCHEMBL17033459 0.91 KDM4E (0.35) L3MBTL1KDM4EATMKMT2AMEN1
SCHEMBL17033757 0.89 KDM4E (0.36) L3MBTL1KDM4EATMKMT2AMEN1
SCHEMBL17033448 0.89 KDM4E (0.35) L3MBTL1KDM4EATMKMT2AMEN1
SCHEMBL17033743 0.88 PTGER4 (0.33) L3MBTL1KDM4EATMKMT2AMEN1
SCHEMBL17033747 0.87 KDM4E (0.38) L3MBTL1KDM4EATMKMT2AMEN1
SCHEMBL17033878 0.87 KMT2A (0.39) L3MBTL1KDM4EATMKMT2AMEN1
SCHEMBL17033435 0.87 KMT2A (0.37) L3MBTL1KDM4EATMKMT2AMEN1
SCHEMBL17033869 0.85 KMT2A (0.40) L3MBTL1KDM4EATMKMT2AMEN1
SCHEMBL17033426 0.85 ATM (0.41) L3MBTL1KDM4EATMKMT2AMEN1

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