SCHEMBL5019895

SCHEMBL5019895

O=c1c2cc(-c3ccc4ccccc4c3)ccc2sc2ccc(-c3ccc4ccccc4c3)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
GSTP1 P09211 1/20 0.48
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
ALOX5 P09917 1/20 0.43
S1PR5 Q9H228 5/20 0.43
S1PR4 O95977 4/20 0.43
CA9 Q16790 2/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
CA12 O43570 1/20 0.41
HDAC4 P56524 1/20 0.41

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
SCHEMBL26503473 0.95 KDM4E (0.57) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL22171901 0.95 KDM4E (0.57) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL14410441 0.89 ESR1 (0.50) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL5019775 0.88 KDM4E (0.49) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL5019898 0.88 KDM4E (0.51) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL15945895 0.84 GPR3 (0.52) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL18086205 0.84 GPR3 (0.52) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL5019864 0.83 KDM4E (0.53) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL5019863 0.83 KDM4E (0.53) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL15893265 0.82 GPR3 (0.50) KDM4ENPC1ALDH1A1MAPTRAB9A

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