SCHEMBL15089279

SCHEMBL15089279

c1ccc(N2c3cccc4cccc(c34)-c3ccc4c(c32)c2ccccc2n4-c2ccc(-c3cccnc3)cn2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.37
G6PD P11413 1/20 0.35
MAPT P10636 4/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPK14 Q16539 1/20 0.33
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
CYP11B1 P15538 4/20 0.31
GFER P55789 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CYP2A6 P11509 1/20 0.31
CYP11B2 P19099 3/20 0.31
CYP17A1 P05093 1/20 0.30
CYP19A1 P11511 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
SCHEMBL15089345 0.96 HTT (0.38) PDE6DG6PDMAPTGAAMAPK1
SCHEMBL15089308 0.96 HTT (0.37) PDE6DG6PDMAPTGAAMAPK1
SCHEMBL15089289 0.94 PDE6D (0.42) PDE6D
SCHEMBL15089062 0.88 MAPT (0.38) PDE6DMAPTGAAMAPK1HTT
SCHEMBL15088929 0.88 PDE6D (0.37) PDE6DMAPTGAAMAPK14KDM4E
SCHEMBL15088940 0.87 PIK3CA (0.35) G6PDMAPTMAPK1MAPK14CYP11B1
SCHEMBL15089309 0.87 HTT (0.38) MAPTGAAMAPK1HTTHSD17B10
SCHEMBL15089288 0.86 HTT (0.41) PDE6DMAPTGAAMAPK1HTT
SCHEMBL15089344 0.85 PDE6D (0.42) PDE6DMAPTGAAMAPK1HTT
SCHEMBL15089304 0.85 HTT (0.42) PDE6DMAPTGAAMAPK1HTT

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