SCHEMBL12110653

SCHEMBL12110653

C=Cc1cc(-n2c3ccccc3c3ncccc32)cc(-n2c3ccccc3c3ncccc32)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.36
L3MBTL1 Q9Y468 5/20 0.36
ATM Q13315 1/20 0.36
HSP90AA1 P07900 4/20 0.35
NPC1 O15118 2/20 0.35
CCR1 P32246 2/20 0.33
CCR8 P51685 2/20 0.33
MPI P34949 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTR1A P08908 1/20 0.32
HTR2A P28223 1/20 0.32
IDO1 P14902 2/20 0.31
MEN1 O00255 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
APP P05067 1/20 0.31
BRD4 O60885 3/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 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
SCHEMBL19888304 0.91 KDM4E (0.32) KDM4EL3MBTL1ATMMPIHTR1A
SCHEMBL11910275 0.89 HTR1A (0.31) L3MBTL1HSP90AA1NPC1HTR1AHTR2A
SCHEMBL12110403 0.88 KDM4E (0.45) KDM4EL3MBTL1ATMHSP90AA1NPC1
SCHEMBL15907063 0.86 KDM4E (0.48) KDM4EL3MBTL1ATMHSP90AA1NPC1
SCHEMBL16923101 0.86 KDM4E (0.44) KDM4EL3MBTL1ATMHSP90AA1NPC1
SCHEMBL4570402 0.86 TOP1 (0.33) KDM4EL3MBTL1ATM
SCHEMBL11910271 0.86 MAOA (0.32)
SCHEMBL13084873 0.83 KDM4E (0.41) KDM4EL3MBTL1ATMHSP90AA1NPC1
SCHEMBL4570366 0.83 KDM4E (0.52) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL261961 0.82 KDM4E (0.47) KDM4EL3MBTL1ATMHSP90AA1NPC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8053024-B2 Method for manufacturing organic electroluminescent device KONICA MINOLTA HOLDINGS, INC. (JP) 2011-11-08 US disclosed
US-8053024-B2 Method for manufacturing organic electroluminescent device KONICA MINOLTA HOLDINGS, INC. (JP) 2011-11-08 US disclosed
US-20090081357-A1 METHOD FOR MANUFACTURING ORGANIC ELECTROLUMINESCENT DEVICE KONICA MINOLTA HOLDINGS, INC. (JP) 2009-03-26 US disclosed
US-20090081357-A1 METHOD FOR MANUFACTURING ORGANIC ELECTROLUMINESCENT DEVICE KONICA MINOLTA HOLDINGS, INC. (JP) 2009-03-26 US disclosed