SCHEMBL15088968

SCHEMBL15088968

c1ccc(N2c3cccc4c(-c5ccccn5)ccc(c34)-c3ccc4c(c32)c2ccccc2n4-c2ccc(-n3c4ccccc4c4ccccc43)cn2)cc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.34
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL15089318 0.87 PDE6D (0.36) KDM4EATML3MBTL1
SCHEMBL15088967 0.85 GRM5 (0.32) MAPK14
SCHEMBL15088966 0.84 MAPK14 (0.33) MAPK14
SCHEMBL15088929 0.84 PDE6D (0.37) MAPK14KDM4E
SCHEMBL15088965 0.81 CYP1A2 (0.33) MAPK14
SCHEMBL15088937 0.81 GRM5 (0.33) MAPK14
SCHEMBL15089309 0.81 HTT (0.38)
SCHEMBL15089071 0.81 CNR2 (0.36)
SCHEMBL15088971 0.80 MAPK14 (0.33) MAPK14
SCHEMBL15089272 0.80 KDM4E (0.40) KDM4EL3MBTL1

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