SCHEMBL15089288

SCHEMBL15089288

c1ccc(N2c3cccc4cccc(c34)-c3ccc4c(c32)c2ccccc2n4-c2cccnc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.41
GAA P10253 2/20 0.41
MAPK1 P28482 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MAPT P10636 1/20 0.41
GFER P55789 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALOX12 P18054 1/20 0.36
CYP1A2 P05177 3/20 0.36
METAP2 P50579 2/20 0.36
RAB9A P51151 1/20 0.36
PDE6D O43924 1/20 0.36
GSK3B P49841 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
MDM2 Q00987 1/20 0.33
CASP1 P29466 2/20 0.32
CASP7 P55210 2/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ATM Q13315 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
SCHEMBL15088853 0.97 HTT (0.44) HTTGAAMAPK1HSD17B10MAPT
SCHEMBL15089319 0.96 HTT (0.44) HTTGAAMAPK1HSD17B10MAPT
SCHEMBL15089403 0.93 HTT (0.43) HTTGAAMAPK1HSD17B10MAPT
SCHEMBL15089375 0.92 HTT (0.42) HTTGAAMAPK1HSD17B10MAPT
SCHEMBL15089322 0.92 HTT (0.42) HTTGAAMAPK1HSD17B10MAPT
SCHEMBL15089344 0.91 PDE6D (0.42) HTTGAAMAPK1HSD17B10MAPT
SCHEMBL15089376 0.90 MAPT (0.39) HTTGAAMAPK1HSD17B10MAPT
SCHEMBL15089281 0.90 MAPT (0.39) HTTGAAMAPK1HSD17B10MAPT
SCHEMBL15089297 0.89 KDM4E (0.40) HTTGAAMAPK1HSD17B10MAPT
SCHEMBL15089271 0.89 KDM4E (0.41) HTTGAAMAPK1HSD17B10MAPT

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