SCHEMBL15089218

SCHEMBL15089218

c1ccc(-c2ccnc(N3c4cc5c(cc4-c4ccc(-c6ccccn6)c6cccc3c46)c3cc(-c4ccccn4)ccc3n5-c3nccc(-c4ccccc4)n3)n2)cc1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.31
DHODH Q02127 1/20 0.31
IRAK4 Q9NWZ3 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
SCHEMBL15089070 0.91 PDE6D (0.33) MAPK14DHODHIRAK4
SCHEMBL15089216 0.91 DHODH (0.34) MAPK14DHODHIRAK4
SCHEMBL15088833 0.89 PIK3CA (0.33)
SCHEMBL15089197 0.89 MAPK14 (0.35) MAPK14IRAK4
SCHEMBL15089199 0.89 MAPK14 (0.31) MAPK14
SCHEMBL15088845 0.87 KDR (0.32) MAPK14IRAK4
SCHEMBL15089251 0.86 PDE6D (0.34) IRAK4
SCHEMBL15089266 0.84 PDE6D (0.38)
SCHEMBL15089211 0.83 MAPK14 (0.33) MAPK14
SCHEMBL15089196 0.83 MAPK14 (0.34) MAPK14DHODH

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