SCHEMBL15089119

SCHEMBL15089119

c1ccc(-n2c3ccccc3c3cc(-c4cccc(N5c6cc7c(cc6-c6cccc8cccc5c68)c5ccccc5n7-c5ccccc5)c4)ccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.42
ATM Q13315 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
PTGER4 P35408 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HTT P42858 2/20 0.32
FAAH O00519 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PKM P14618 1/20 0.32
MGLL Q99685 1/20 0.32
POLB P06746 1/20 0.32
TSPO P30536 1/20 0.31
HDAC4 P56524 1/20 0.31
KMT2A Q03164 2/20 0.30
IL1R1 P14778 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
PDE10A Q9Y233 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 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
SCHEMBL15088912 0.99 PDE6D (0.41) PDE6DATML3MBTL1KDM4EPTGER4
SCHEMBL15089195 0.99 PDE6D (0.44) PDE6DATML3MBTL1KDM4EPTGER4
SCHEMBL15089339 0.98 PDE6D (0.43) PDE6DATML3MBTL1KDM4EPTGER4
SCHEMBL15089126 0.96 PDE6D (0.43) PDE6DATML3MBTL1KDM4EALDH1A1
SCHEMBL15089156 0.96 PDE6D (0.46) PDE6DATML3MBTL1KDM4EALDH1A1
SCHEMBL15089263 0.95 PDE6D (0.44) PDE6DATML3MBTL1KDM4EALDH1A1
SCHEMBL15088838 0.94 PDE6D (0.45) PDE6DATML3MBTL1KDM4EALDH1A1
SCHEMBL15089169 0.94 PDE6D (0.41) PDE6DATML3MBTL1KDM4EPTGER4
SCHEMBL15089370 0.94 PDE6D (0.50) PDE6DATML3MBTL1KDM4EPTGER4
SCHEMBL15089368 0.93 PDE6D (0.46) PDE6DATMALDH1A1HTTFAAH

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