SCHEMBL15089197

SCHEMBL15089197

c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ncccn2)N(c2ncccn2)c2cccc3c(-c5ccccn5)ccc-4c23)nc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.32
NPY5R Q15761 1/20 0.31
PRMT5 O14744 1/20 0.31
PDK2 Q15119 1/20 0.31
PIM1 P11309 1/20 0.31
PIM3 Q86V86 1/20 0.31
CNR2 P34972 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
SCHEMBL15088845 0.94 KDR (0.32) MAPK14IRAK4NPY5RPRMT5PIM1
SCHEMBL15089218 0.89 MAPK14 (0.31) MAPK14IRAK4
SCHEMBL15089035 0.89 IRAK4 (0.34) MAPK14IRAK4NPY5RPDK2PIM1
SCHEMBL15089216 0.89 DHODH (0.34) MAPK14IRAK4NPY5R
SCHEMBL15089196 0.87 MAPK14 (0.34) MAPK14NPY5RPRMT5PDK2PIM1
SCHEMBL15089199 0.86 MAPK14 (0.31) MAPK14
SCHEMBL15089219 0.86 MAPK14 (0.36) MAPK14NPY5RPRMT5PIM1PIM3
SCHEMBL15089172 0.85 CNR2 (0.39) MAPK14IRAK4PRMT5CNR2
SCHEMBL15089171 0.85 COMT (0.33) MAPK14IRAK4CNR2
SCHEMBL15089177 0.85 MAPK14 (0.35) MAPK14NPY5RPIM1PIM3

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