SCHEMBL16613529

SCHEMBL16613529

c1ccc(-n2ccc3c2ccc2c4ccccc4n(-c4nc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)c5ccsc5n4)c23)cc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
VCP P55072 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
DUSP3 P51452 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
POLB P06746 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
SCHEMBL16613487 0.94 VCP (0.33) VCPDUSP3
SCHEMBL16613457 0.92 VCP (0.32) VCP
SCHEMBL16613419 0.92 VCP (0.33) VCP
SCHEMBL16613453 0.89 VCP (0.35) VCPKDM4EATML3MBTL1MEN1
SCHEMBL16613528 0.89 VCP (0.30) VCP
SCHEMBL16613420 0.88 VCP (0.31) VCP
SCHEMBL16613468 0.88 VCP (0.34) VCP
SCHEMBL16613424 0.87
SCHEMBL16613454 0.87 VCP (0.33) VCP
SCHEMBL16613488 0.87 KDM4E (0.40) VCPKDM4EATML3MBTL1DUSP3

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-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed