SCHEMBL19051622

SCHEMBL19051622

c1ccc(-c2ccc(-c3cc(-c4ccc(-n5c6ccccc6c6ccc(-n7ncc8c7ccc7c9ccccc9n(-c9ccccc9)c78)cc65)cc4)nc(-c4ccccc4)n3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.36
▸ ATM Q13315 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PTGS2 P35354 2/20 0.35
▸ MAPT P10636 5/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ HPGD P15428 2/20 0.34
▸ NTSR1 P30989 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ MAP4K1 Q92918 1/20 0.33
▸ PGR P06401 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ HTT P42858 1/20 0.32
▸ RAC2 P15153 1/20 0.32
▸ RAC3 P60763 1/20 0.32
▸ CDC42 P60953 1/20 0.32
▸ RAC1 P63000 1/20 0.32

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
SCHEMBL19051900 0.96 NR3C1 (0.40) NR3C1KDM4EATML3MBTL1PTGS2
SCHEMBL16918822 0.95 NR3C1 (0.41) NR3C1KDM4EATML3MBTL1PTGS2
SCHEMBL19051619 0.94 NR3C1 (0.40) NR3C1KDM4EATML3MBTL1PTGS2
SCHEMBL19051852 0.93 NR3C1 (0.38) NR3C1KDM4EATML3MBTL1PTGS2
SCHEMBL19052196 0.91 NR3C1 (0.39) NR3C1KDM4EATML3MBTL1PTGS2
SCHEMBL19051899 0.90 NR3C1 (0.40) NR3C1KDM4EATML3MBTL1PTGS2
SCHEMBL19052213 0.89 NR3C1 (0.38) NR3C1KDM4EATML3MBTL1PTGS2
SCHEMBL19051652 0.89 NR3C1 (0.37) NR3C1KDM4EATML3MBTL1PTGS2
SCHEMBL19051897 0.89 MAPT (0.37) NR3C1KDM4EATML3MBTL1PTGS2
SCHEMBL19051614 0.89 NR3C1 (0.37) NR3C1KDM4EATML3MBTL1PTGS2

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-2017111360-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 주식회사 두산 2017-06-29 — — WO disclosed
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