SCHEMBL9914809

SCHEMBL9914809

O=Cc1cccc(-c2cccc3c(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)cccc23)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
GSTP1 P09211 1/20 0.41
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
GPR84 Q9NQS5 1/20 0.39
TRIM24 O15164 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
AXL P30530 1/20 0.38
BRD4 O60885 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
S1PR4 O95977 3/20 0.37
S1PR5 Q9H228 3/20 0.37
PRKDC P78527 1/20 0.37
ERN1 O75460 3/20 0.37
HSD17B1 P14061 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
SCHEMBL9914780 0.92 RAB9A (0.44) HDAC4HDAC2HDAC8GSTP1NPC1
SCHEMBL9914781 0.87 TRIM24 (0.48) GSTP1NPC1RAB9ATRIM24TRIM33
SCHEMBL9914789 0.87 NPC1 (0.43) NPC1RAB9ATRIM24TRIM33AXL
SCHEMBL9914814 0.86 TRIM24 (0.43) GSTP1NPC1RAB9ATRIM24TRIM33
SCHEMBL9914823 0.86 TRIM24 (0.43) GSTP1NPC1RAB9ATRIM24TRIM33
SCHEMBL25634493 0.82 HDAC4 (0.49) HDAC4HDAC2HDAC8GSTP1GPR84
SCHEMBL9914807 0.82 ERN1 (0.43) HDAC4HDAC2HDAC8GSTP1GPR84
SCHEMBL24446307 0.81 MCL1 (0.46) HDAC4HDAC2HDAC8GSTP1GPR84
SCHEMBL7569927 0.81 NPC1 (0.48) HDAC8NPC1RAB9ATRIM24TRIM33
SCHEMBL10227496 0.81 TRIM24 (0.54) GSTP1NPC1RAB9ATRIM24TRIM33

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-8197951-B2 Emitting material and organic light emitting diode using the same LG CHEM, LTD. (KR) 2012-06-12 US disclosed
US-8197951-B2 Emitting material and organic light emitting diode using the same LG CHEM, LTD. (KR) 2012-06-12 US disclosed
US-20070202355-A1 Emitting material and organic light emitting diode using the same LG CHEM. LTD. (KR) 2007-08-30 US disclosed
US-20070202355-A1 Emitting material and organic light emitting diode using the same LG CHEM. LTD. (KR) 2007-08-30 US disclosed
WO-2007058503-A1 EMITTING MATERIAL AND ORGANIC LIGHT EMITTING DIODE USING THE SAME LG CHEM. LTD. (KR) 2007-05-24 WO disclosed