SCHEMBL17033453

SCHEMBL17033453

c1ccc(-c2cc(-n3c4ccccc4c4cc5c(cc43)cc3c4ccccc4c4ccccc4n53)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
MAPK1 P28482 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
TSHR P16473 2/20 0.43
HSD17B10 Q99714 2/20 0.43
HPGD P15428 4/20 0.42
ADORA1 P30542 2/20 0.36
ADORA2A P29274 1/20 0.36
KMT2A Q03164 6/20 0.35
MEN1 O00255 5/20 0.35
ALDH1A1 P00352 3/20 0.35
NTSR1 P30989 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 4/20 0.32
LMNA P02545 2/20 0.32
GLA P06280 1/20 0.32
ACHE P22303 1/20 0.32
NPY5R Q15761 1/20 0.32
PARP1 P09874 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
SCHEMBL17033523 0.98 MAPT (0.41) MAPTMAPK1NPSR1TSHRHSD17B10
SCHEMBL17033608 0.96 MAPT (0.42) MAPTMAPK1NPSR1TSHRHSD17B10
SCHEMBL17033407 0.94 MAPT (0.41) MAPTMAPK1NPSR1TSHRHSD17B10
SCHEMBL16066211 0.93 MAPT (0.43) MAPTMAPK1NPSR1TSHRHSD17B10
SCHEMBL16066401 0.91 MAPT (0.41) MAPTMAPK1NPSR1TSHRHSD17B10
SCHEMBL16067239 0.91 MAPT (0.41) MAPTMAPK1NPSR1TSHRHSD17B10
SCHEMBL16067015 0.89 MAPT (0.42) MAPTMAPK1NPSR1TSHRHSD17B10
SCHEMBL16362437 0.89 MAPT (0.48) MAPTMAPK1NPSR1TSHRHSD17B10
SCHEMBL17033470 0.88 KDM4E (0.36) MAPTMAPK1NPSR1TSHRHSD17B10
SCHEMBL17033799 0.87 MAPT (0.42) MAPTMAPK1NPSR1TSHRHSD17B10

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-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 WO disclosed