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SCHEMBL17033723

SCHEMBL17033723

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccc7c(nc8c9ccccc9c9ccccc9n78)c65)cc4)c3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ RXRA P19793 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ ALDH1A1 P00352 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
SCHEMBL17033698 0.95 KDM4E (0.35) NR3C1KDM4EATML3MBTL1RXRA
SCHEMBL17033665 0.94 KDM4E (0.36) KDM4EATML3MBTL1RXRAALDH1A1
SCHEMBL17033700 0.93 GAA (0.33) NR3C1KDM4EATML3MBTL1POLB
SCHEMBL17033722 0.93 MEN1 (0.33) KDM4EATML3MBTL1POLBALDH1A1
SCHEMBL17033697 0.91 GAA (0.34) KDM4EATML3MBTL1POLBALDH1A1
SCHEMBL17033692 0.91 POLB (0.32) KDM4EPOLBALDH1A1HPGD
SCHEMBL17033895 0.90 KDM4E (0.31) KDM4EATML3MBTL1ALDH1A1HPGD
SCHEMBL17033473 0.87 KDM4E (0.33) KDM4EATMPOLBALDH1A1HPGD
SCHEMBL17033678 0.87 GAA (0.36) NR3C1KDM4EATML3MBTL1POLB
SCHEMBL17033676 0.86 KDM4E (0.34) KDM4EATML3MBTL1POLBALDH1A1

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