SCHEMBL5019914

SCHEMBL5019914

CC1(C)c2ccccc2-c2ccc(-c3ccc4sc5ccc(-c6cc(-c7ccccc7)cc(-c7ccccc7)c6)cc5c(=O)c4c3)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 6/20 0.39
NPC1 O15118 2/20 0.36
MAPT P10636 2/20 0.36
RAB9A P51151 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 1/20 0.36
APAF1 O14727 1/20 0.36
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36
XBP1 P17861 1/20 0.36
PTBP1 P26599 1/20 0.36
HTT P42858 1/20 0.36
GALK1 P51570 1/20 0.36
BLM P54132 1/20 0.36
SMAD3 P84022 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL5019792 0.94 KDM4E (0.40) PDK2NPC1MAPTRAB9AL3MBTL1
SCHEMBL15216405 0.92 MAPT (0.44) PDK2NPC1MAPTRAB9AL3MBTL1
SCHEMBL5019794 0.86 KDM4E (0.40) NPC1MAPTRAB9AL3MBTL1KDM4E
SCHEMBL10018885 0.86 PDK2 (0.38) PDK2
SCHEMBL16788575 0.85 PIM3 (0.40) PDK2MAPTRAB9AL3MBTL1ALDH1A1
SCHEMBL15216408 0.84 MAPT (0.44) NPC1MAPTRAB9AL3MBTL1KDM4E
SCHEMBL5019778 0.84 ALDH1A1 (0.39) PDK2NPC1MAPTRAB9AL3MBTL1
SCHEMBL15216400 0.83 PGR (0.35) PDK2NPC1MAPTRAB9AL3MBTL1
SCHEMBL15614290 0.83 PDK2 (0.39) PDK2PIM3ROCK1PIM1PIM2
SCHEMBL15614539 0.83 PDK2 (0.39) PDK2PIM3ROCK1PIM1PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8952367-B2 Thioxanthone compound and organic light emitting element having the same CANON KABUSHIKI KAISHA (JP) 2015-02-10 US disclosed
US-8952367-B2 Thioxanthone compound and organic light emitting element having the same CANON KABUSHIKI KAISHA (JP) 2015-02-10 US disclosed
US-20130221340-A1 THIOXANTHONE COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-08-29 US disclosed
US-20130221340-A1 THIOXANTHONE COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-08-29 US disclosed
WO-2012063751-A1 THIOXANTHONE COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT HAVING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-05-18 WO disclosed