SCHEMBL16425011

SCHEMBL16425011

c1ccc(-c2cccc(-n3c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4c4ccc5c(cnn5-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c43)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ TP53 P04637 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ PTGER4 P35408 1/20 0.33
▸ PIK3CA P42336 4/20 0.33
▸ MTOR P42345 4/20 0.33
▸ THRB P10828 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ PGR P06401 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ RAC2 P15153 1/20 0.31
▸ RAC3 P60763 1/20 0.31
▸ CDC42 P60953 1/20 0.31
▸ RAC1 P63000 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
SCHEMBL16425018 0.94 NR3C1 (0.38) NR3C1KDM4EATML3MBTL1TP53
SCHEMBL19051633 0.90 NR3C1 (0.39) NR3C1KDM4EATML3MBTL1TP53
SCHEMBL16424969 0.90 NR3C1 (0.41) NR3C1KDM4ETP53MAPTPIK3CA
SCHEMBL16424989 0.90 NR3C1 (0.40) NR3C1KDM4EATML3MBTL1TP53
SCHEMBL16425016 0.90 NR3C1 (0.40) NR3C1KDM4EATML3MBTL1TP53
SCHEMBL19052201 0.88 RAC2 (0.37) NR3C1KDM4EATML3MBTL1TP53
SCHEMBL19052196 0.88 NR3C1 (0.39) NR3C1KDM4EATML3MBTL1TP53
SCHEMBL19051627 0.88 RAC2 (0.39) NR3C1KDM4EATML3MBTL1TP53
SCHEMBL15811174 0.88 NR3C1 (0.45) NR3C1KDM4EATML3MBTL1TP53
SCHEMBL15811208 0.88 NR3C1 (0.39) NR3C1KDM4EATML3MBTL1TP53

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-2015012528-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 (KR) 2015-01-29 — — WO disclosed
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