SCHEMBL15088943

SCHEMBL15088943

c1ccc(-c2ncnc(-n3c4ccccc4c4c5c(ccc43)-c3cccc4cccc(c34)N5c3cccnc3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GFER P55789 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PDE6D O43924 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPK14 Q16539 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
SCHEMBL15088904 0.92 PDE6D (0.38) PDE6D
SCHEMBL15088963 0.91 MAPT (0.39) HTTMAPTGAAMAPK1HSD17B10
SCHEMBL15089307 0.88 HTT (0.36) HTTMAPTGAAMAPK1HSD17B10
SCHEMBL15089319 0.86 HTT (0.44) HTTMAPTGAAMAPK1HSD17B10
SCHEMBL15089283 0.86 HTT (0.38) HTTMAPTGAAMAPK1HSD17B10
SCHEMBL15089344 0.86 PDE6D (0.42) HTTMAPTGAAMAPK1HSD17B10
SCHEMBL15088853 0.85 HTT (0.44) HTTMAPTGAAMAPK1HSD17B10
SCHEMBL15089376 0.85 MAPT (0.39) HTTMAPTGAAMAPK1HSD17B10
SCHEMBL15089343 0.85 HSD17B10 (0.35) HTTMAPTGAAMAPK1HSD17B10
SCHEMBL15089049 0.85

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