SCHEMBL13656605

SCHEMBL13656605

c1ccc(-c2ccc(-c3ccc(-c4ccc5c(-c6cccc7ccccc67)c6ccccc6c(-c6cccc7ccccc67)c5c4)s3)s2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.45
CA1 P00915 4/20 0.45
CA2 P00918 4/20 0.45
CA9 Q16790 4/20 0.45
HSD17B1 P14061 5/20 0.42
HSD17B2 P37059 5/20 0.42
CYP1A1 P04798 2/20 0.41
CYP1B1 Q16678 2/20 0.41
NQO2 P16083 2/20 0.40
MCL1 Q07820 1/20 0.38
ACMSD Q8TDX5 1/20 0.38
PRKDC P78527 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
NFKB1 P19838 1/20 0.37
MAPK1 P28482 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
SCHEMBL13656618 1.00 CA12 (0.45) CA12CA1CA2CA9HSD17B1
SCHEMBL13656600 0.98 CA12 (0.46) CA12CA1CA2CA9HSD17B1
SCHEMBL13656592 0.98 CA12 (0.46) CA12CA1CA2CA9HSD17B1
SCHEMBL12578081 0.94 CA12 (0.45) CA12CA1CA2CA9HSD17B1
SCHEMBL12571793 0.90 CA12 (0.40) CA12CA1CA2CA9HSD17B1
SCHEMBL12700835 0.88 HSD17B1 (0.45) CA12CA1CA2CA9HSD17B1
SCHEMBL12700833 0.87 CA12 (0.45) CA12CA1CA2CA9HSD17B1
SCHEMBL12571789 0.87 CA12 (0.40) CA12CA1CA2CA9HSD17B1
SCHEMBL15763553 0.87 CA12 (0.46) CA12CA1CA2CA9HSD17B1
SCHEMBL12571813 0.86 CA12 (0.41) CA12CA1CA2CA9HSD17B1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501821-B1 NEW ORGANIC COMPOUNDS FOR ELECTROLUMINESCENCE AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME LG CHEMICAL LTD (KR) 2016-07-20 EP disclosed
US-7604874-B2 Organic compounds for electroluminescence and organic electroluminescent devices using the same LG CHEM, LTD. (KR) 2009-10-20 US disclosed
US-7604874-B2 Organic compounds for electroluminescence and organic electroluminescent devices using the same LG CHEM, LTD. (KR) 2009-10-20 US disclosed
US-7485733-B2 Organic compounds for electroluminescence and organic electroluminescent devices using the same LG CHEM, LTD. (KR) 2009-02-03 US disclosed
US-7485733-B2 Organic compounds for electroluminescence and organic electroluminescent devices using the same LG CHEM, LTD. (KR) 2009-02-03 US disclosed
US-20070037012-A1 having an anthracene compound substituted with at least one thiophenyl ring; OLED organic light emitters; as displays with low power consumption, faster response time, higher brightness level, unlimited viewing angle LG CHEM, LTD. (KR) 2007-02-15 US disclosed
US-20070037012-A1 having an anthracene compound substituted with at least one thiophenyl ring; OLED organic light emitters; as displays with low power consumption, faster response time, higher brightness level, unlimited viewing angle LG CHEM, LTD. (KR) 2007-02-15 US disclosed