SCHEMBL15089378

SCHEMBL15089378

c1ccc(-c2ccc(N3c4cc5sc6ccccc6c5cc4-c4cccc5cccc3c45)nc2)nc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.36
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 4/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 3/20 0.36
MIF P14174 1/20 0.35
GABRA1 P14867 1/20 0.35
DCTPP1 Q9H773 1/20 0.32
TGFBR1 P36897 1/20 0.32
PDE6D O43924 1/20 0.32
PDE5A O76074 2/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
PI4KA P42356 1/20 0.32
PIK3CG P48736 1/20 0.32
PI4KB Q9UBF8 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 2/20 0.31
HPGD P15428 2/20 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
SCHEMBL15089333 0.87 KDM4E (0.45) KDM4EALDH1A1GAAMAPTMIF
SCHEMBL15089406 0.87 CYP11B1 (0.35) KDM4EALDH1A1GAAMAPTTGFBR1
SCHEMBL15088922 0.82 MAPT (0.39) CNR2KDM4EALDH1A1GAAMAPT
SCHEMBL15089334 0.82 ALDH1A1 (0.39) KDM4EALDH1A1GAAMAPTMIF
SCHEMBL15089135 0.81 KDM4E (0.40) CNR2KDM4EALDH1A1GAAMAPT
SCHEMBL15089060 0.80 MAPT (0.39) CNR2KDM4EALDH1A1GAAMAPT
SCHEMBL15089380 0.80 PDE6D (0.31) PDE6D
SCHEMBL15089415 0.80 METAP1 (0.33) MIFGABRA1TGFBR1HTR2C
SCHEMBL15089404 0.79 PDE6D (0.37) KDM4EALDH1A1GAAMAPTPDE6D
SCHEMBL15089243 0.79 KDM4E (0.40) CNR2KDM4EALDH1A1GAAMAPT

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-2013100497-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2013-07-04 WO disclosed