SCHEMBL22706393

SCHEMBL22706393

Cc1nc2ccccc2n1-c1cccc2c(-c3c4cccc(-c5cccc6ccccc56)c4cc4c(-c5cccc6ccccc56)cccc34)c3cccc(-n4c(C)nc5ccccc54)c3cc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
GSR P00390 2/20 0.45
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
HCAR1 Q9BXC0 1/20 0.43
FLT3 P36888 3/20 0.41
ALDH1A1 P00352 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
LMNA P02545 2/20 0.39
HSD17B10 Q99714 2/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CB P42338 1/20 0.37
PIK3CG P48736 1/20 0.37
RAB9A P51151 1/20 0.37
NR1H2 P55055 1/20 0.37

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
SCHEMBL22705749 0.94 TSHR (0.54) TSHRGSRMAPK1HTTHCAR1
SCHEMBL22706428 0.89 TSHR (0.51) TSHRGSRMAPK1HTTHCAR1
SCHEMBL22706610 0.88 TSHR (0.56) TSHRGSRMAPK1HTTHCAR1
SCHEMBL22707526 0.87 TSHR (0.47) TSHRGSRMAPK1HTTHCAR1
SCHEMBL22705652 0.86 TSHR (0.51) TSHRGSRMAPK1HTTHCAR1
SCHEMBL26343527 0.86 TSHR (0.56) TSHRGSRMAPK1HTTHCAR1
SCHEMBL22705784 0.85 GSR (0.43) GSRHTTFLT3ALDH1A1LMNA
SCHEMBL22705785 0.85 TSHR (0.52) TSHRGSRMAPK1HTTHCAR1
SCHEMBL22705757 0.85 TSHR (0.55) TSHRGSRMAPK1HTTHCAR1
SCHEMBL22707354 0.84 TSHR (0.51) TSHRGSRMAPK1HTTHCAR1

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
US-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 US disclosed