SCHEMBL9914797

SCHEMBL9914797

O=Cc1ccc2cc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)ccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.41
KIF11 P52732 2/20 0.41
RAB9A P51151 2/20 0.39
GSTP1 P09211 1/20 0.39
RELA Q04206 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
CYP1A1 P04798 1/20 0.38
CYP1B1 Q16678 1/20 0.38
ALOX5 P09917 1/20 0.38
PDE9A O76083 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
NPC1 O15118 1/20 0.37
HSD17B1 P14061 1/20 0.37
HSD17B2 P37059 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL27949350 0.94 RAB9A (0.42) ERN1KIF11RAB9AGSTP1RELA
SCHEMBL9914814 0.91 TRIM24 (0.43) ERN1KIF11RAB9AGSTP1ESR1
SCHEMBL9914823 0.91 TRIM24 (0.43) ERN1KIF11RAB9AGSTP1ESR1
SCHEMBL12176780 0.87 RAB9A (0.43) ERN1KIF11RAB9AGSTP1RELA
SCHEMBL12571883 0.86 ALOX5 (0.49) ERN1KIF11RAB9AGSTP1RELA
SCHEMBL2964464 0.85 ESR1 (0.50) RAB9AGSTP1ESR1ESR2CYP1A1
SCHEMBL269358 0.85 ESR1 (0.50) RAB9AGSTP1ESR1ESR2CYP1A1
SCHEMBL9914780 0.84 RAB9A (0.44) ERN1RAB9AGSTP1RELAESR1
SCHEMBL9914781 0.84 TRIM24 (0.48) ERN1RAB9AGSTP1ESR1ESR2
SCHEMBL21238074 0.82 ESR1 (0.52) GSTP1ESR1ESR2CYP1A1CYP1B1

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 4 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