SCHEMBL15965741

SCHEMBL15965741

c1cnc(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c(-c2ccc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3c2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
FEN1 P39748 1/20 0.34
KDM4E B2RXH2 3/20 0.33
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
ALOX5 P09917 1/20 0.32
TGFBR1 P36897 7/20 0.32
NCOA1 Q15788 1/20 0.32
TP53 P04637 1/20 0.31
ACVR1 Q04771 1/20 0.31
NPY5R Q15761 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SIRT2 Q8IXJ6 1/20 0.30
SIRT1 Q96EB6 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
SCHEMBL15965707 0.93 KMO (0.35) KMONPC1MAPTFEN1KDM4E
SCHEMBL14770615 0.88 NPC1 (0.35) NPC1MAPTKDM4EATML3MBTL1
SCHEMBL15965723 0.86 KDM4E (0.42) NPC1MAPTKDM4EHSP90AA1HSP90AB1
SCHEMBL15965690 0.86 NPC1 (0.35) NPC1MAPTKDM4EHSP90AA1HSP90AB1
SCHEMBL14849192 0.84 ALDH1A1 (0.36) NPC1MAPTKDM4EATML3MBTL1
SCHEMBL15965685 0.83 KDM4E (0.41) NPC1MAPTKDM4EHSP90AA1HSP90AB1
SCHEMBL10348766 0.83 NPC1 (0.36) NPC1MAPTKDM4EATML3MBTL1
SCHEMBL10123521 0.83 NPY5R (0.37) NPC1MAPTKDM4EATML3MBTL1
SCHEMBL11946077 0.83 NPY5R (0.37) NPC1MAPTKDM4EATML3MBTL1
SCHEMBL15965691 0.83 MAPT (0.33) NPC1MAPTKDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140231772-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME IDEMITSU KOSAN CO., LTD. 2014-08-21 US disclosed
US-20140231772-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME IDEMITSU KOSAN CO., LTD. 2014-08-21 US disclosed