SCHEMBL17033441

SCHEMBL17033441

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccc7c(cc8c9ccccc9c9ccccc9n87)c65)cc4)c3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NR3C1 P04150 1/20 0.34
HDAC4 P56524 1/20 0.31
KMT2A Q03164 2/20 0.31
RXRA P19793 1/20 0.31
PTGER4 P35408 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
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 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
SCHEMBL17033438 0.95 L3MBTL1 (0.37) KDM4EATML3MBTL1NR3C1HDAC4
SCHEMBL17033449 0.94 KDM4E (0.38) KDM4EATML3MBTL1NR3C1HDAC4
SCHEMBL17033448 0.92 KDM4E (0.35) KDM4EATML3MBTL1NR3C1KMT2A
SCHEMBL17033459 0.92 KDM4E (0.35) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033743 0.91 PTGER4 (0.33) KDM4EATML3MBTL1NR3C1KMT2A
SCHEMBL17033747 0.90 KDM4E (0.38) KDM4EATML3MBTL1KMT2APTGER4
SCHEMBL17033454 0.90 KDM4E (0.36) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033437 0.90 KDM4E (0.31) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL17033893 0.89 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL17033645 0.88 KDM4E (0.33) KDM4EATML3MBTL1NR3C1HDAC4

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