SCHEMBL15089282

SCHEMBL15089282

c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c5c(ccc43)-c3cccc4cccc(c34)N5c3cccnc3)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
HTT P42858 2/20 0.36
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP19A1 P11511 1/20 0.35
PDE6D O43924 1/20 0.33
GFER P55789 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
DHODH Q02127 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 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
SCHEMBL15089298 0.92 PDE6D (0.39) PDE6D
SCHEMBL15089331 0.92 MAPT (0.36) MAPTHTTGAAMAPK1HSD17B10
SCHEMBL15089321 0.91 MAPT (0.36) MAPTHTTGAAMAPK1HSD17B10
SCHEMBL15089283 0.89 HTT (0.38) MAPTHTTGAAMAPK1HSD17B10
SCHEMBL15089281 0.89 MAPT (0.39) MAPTHTTGAAMAPK1HSD17B10
SCHEMBL15089299 0.89 PDE6D (0.36) MAPTPDE6DKDM4EALDH1A1HPGD
SCHEMBL15089376 0.88 MAPT (0.39) MAPTHTTGAAMAPK1HSD17B10
SCHEMBL15089332 0.88 GAA (0.34) MAPTHTTGAAMAPK1HSD17B10
SCHEMBL15089343 0.88 HSD17B10 (0.35) MAPTHTTGAAMAPK1HSD17B10
SCHEMBL15089344 0.87 PDE6D (0.42) MAPTHTTGAAMAPK1HSD17B10

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