SCHEMBL15965707

SCHEMBL15965707

c1cnc(-c2ccc3oc4ccc(-n5c6ccccc6c6ncccc65)cc4c3c2)c(-c2ccc3oc4ccc(-n5c6ccccc6c6ncccc65)cc4c3c2)c1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.35
FEN1 P39748 1/20 0.34
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
PDE4D Q08499 2/20 0.32
TRPV1 Q8NER1 1/20 0.31
TGFBR1 P36897 5/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
KDM4E B2RXH2 1/20 0.30
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30
ALOX5 P09917 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
SCHEMBL15965741 0.93 KMO (0.35) KMOFEN1NPC1MAPTTGFBR1
SCHEMBL15965690 0.93 NPC1 (0.35) NPC1MAPTPDE4DHSP90AA1HSP90AB1
SCHEMBL10348765 0.90 NPC1 (0.37) NPC1MAPTPDE4DKDM4E
SCHEMBL15965705 0.89 MAPK9 (0.38) NPC1MAPT
SCHEMBL10348766 0.89 NPC1 (0.36) NPC1MAPTPDE4DKDM4E
SCHEMBL15965697 0.88 MAPT (0.38) NPC1MAPTPDE4DHSP90AA1HSP90AB1
SCHEMBL4570442 0.87 MAPT (0.40) NPC1MAPTPDE4DHSP90AA1KDM4E
SCHEMBL10041352 0.86 PLA2G2A (0.36) NPC1MAPTPDE4DKDM4E
SCHEMBL10041330 0.86 PLA2G2A (0.36) NPC1MAPTPDE4DKDM4E
SCHEMBL17264917 0.85 MAPK14 (0.33) NPC1MAPTPDE4DTGFBR1

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