SCHEMBL5019913

SCHEMBL5019913

O=c1c2cc(-c3ccccc3)ccc2sc2ccc(-c3cccc(-c4cccc5c4sc4ccccc45)c3)cc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.56
KDM4E B2RXH2 3/20 0.44
PRKDC P78527 4/20 0.44
TNKS O95271 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
ALDH1A1 P00352 3/20 0.42
MAPT P10636 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
PARP14 Q460N5 1/20 0.40
LIMK1 P53667 1/20 0.40
PIM3 Q86V86 2/20 0.40
PIM1 P11309 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
PIK3CD O00329 1/20 0.38
BRD4 O60885 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38

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
SCHEMBL10062358 0.97 ALOX5 (0.58) ALOX5KDM4EPRKDCTNKSTNKS2
SCHEMBL5019867 0.96 ALOX5 (0.57) ALOX5KDM4EPRKDCTNKSTNKS2
SCHEMBL5019865 0.96 ALOX5 (0.57) ALOX5KDM4EPRKDCTNKSTNKS2
SCHEMBL15216402 0.93 ALOX5 (0.62) ALOX5KDM4EPRKDCTNKSTNKS2
SCHEMBL17057267 0.92 ALOX5 (0.61) ALOX5PRKDCTNKSTNKS2ALDH1A1
SCHEMBL17057253 0.92 ALOX5 (0.61) ALOX5PRKDCTNKSTNKS2ALDH1A1
SCHEMBL17057189 0.90 ALOX5 (0.62) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL17057268 0.90 ALOX5 (0.62) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL17057255 0.89 ALOX5 (0.57) ALOX5PRKDCTNKSTNKS2ALDH1A1
SCHEMBL17057269 0.89 ALOX5 (0.57) ALOX5PRKDCTNKSTNKS2ALDH1A1

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