SCHEMBL15089331

SCHEMBL15089331

c1ccc(-c2cc(-n3c4ccccc4c4c5c(ccc43)-c3cccc4cccc(c34)N5c3cccnc3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.36
MAPK1 P28482 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HTT P42858 2/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
CYP3A4 P08684 2/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
GFER P55789 1/20 0.32
TSHR P16473 1/20 0.31
PDE6D O43924 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 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
SCHEMBL15089275 0.92 PDE6D (0.37) MAPTMAPK1HSD17B10HPGDNPSR1
SCHEMBL15089282 0.92 MAPT (0.36) MAPTMAPK1HSD17B10HTTGAA
SCHEMBL15089343 0.89 HSD17B10 (0.35) MAPTMAPK1HSD17B10HTTGAA
SCHEMBL15089283 0.89 HTT (0.38) MAPTMAPK1HSD17B10HTTGAA
SCHEMBL15088963 0.89 MAPT (0.39) MAPTMAPK1HSD17B10HTTGAA
SCHEMBL15089306 0.87 MAPT (0.35) MAPTMAPK1HSD17B10HTTGAA
SCHEMBL15089376 0.86 MAPT (0.39) MAPTMAPK1HSD17B10HTTGAA
SCHEMBL15089321 0.86 MAPT (0.36) MAPTMAPK1HSD17B10HTTGAA
SCHEMBL15089319 0.86 HTT (0.44) MAPTMAPK1HSD17B10HTTGAA
SCHEMBL15089281 0.85 MAPT (0.39) MAPTMAPK1HSD17B10HTTGAA

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