SCHEMBL5019871

SCHEMBL5019871

O=c1c2ccc(-c3cccc(-c4cccc(-c5ccccc5)c4)c3)cc2sc2cc(-c3cccc(-c4cccc(-c5ccccc5)c4)c3)ccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.44
KDM4E B2RXH2 2/20 0.42
PIK3CA P42336 1/20 0.41
PI4KA P42356 1/20 0.41
PI4KB Q9UBF8 1/20 0.41
RAB9A P51151 3/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 1/20 0.41
PSMB8 P28062 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
KMO O15229 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
ACMSD Q8TDX5 1/20 0.40
MAP3K8 P41279 1/20 0.39
NPC1 O15118 2/20 0.39

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
SCHEMBL5019798 1.00 LIMK1 (0.44) LIMK1KDM4EPIK3CAPI4KAPI4KB
SCHEMBL5019868 0.96 LIMK1 (0.44) LIMK1KDM4EPIK3CAPI4KAPI4KB
SCHEMBL5019791 0.96 LIMK1 (0.46) LIMK1KDM4EPIK3CAPI4KAPI4KB
SCHEMBL31124705 0.96 LIMK1 (0.46) LIMK1KDM4EPIK3CAPI4KAPI4KB
SCHEMBL15216399 0.91 KDM4E (0.53) LIMK1KDM4EPIK3CAPI4KAPI4KB
SCHEMBL5019862 0.85 KDM4E (0.50) LIMK1KDM4ERAB9AALDH1A1LMNA
SCHEMBL22171902 0.84 KDM4E (0.58) LIMK1KDM4ERAB9AALDH1A1LMNA
SCHEMBL12562737 0.84 LIMK1 (0.51) LIMK1KDM4EPIK3CAPI4KAPI4KB
SCHEMBL10110898 0.84 LIMK1 (0.51) LIMK1KDM4EPIK3CAPI4KAPI4KB
SCHEMBL15216401 0.83 KDM4E (0.47) LIMK1KDM4ERAB9AALDH1A1LMNA

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