SCHEMBL16850822

SCHEMBL16850822

c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3ccc4c(c3)oc3cc(-c5ccc6c(c5)c5cccc7c8ccccc8n6c75)ccc34)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
PRKDC P78527 2/20 0.38
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.33
GGPS1 O95749 1/20 0.33
TSPO P30536 1/20 0.33
PLA2G2A P14555 2/20 0.32
PLA2G4A P47712 2/20 0.32
PLA2G10 O15496 1/20 0.31

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
SCHEMBL16842916 0.95 ALOX5 (0.39) ALOX5PRKDCMMP12MMP13PTGES2
SCHEMBL17612092 0.94 ALOX5 (0.43) ALOX5PRKDCPTGES2GGPS1TSPO
SCHEMBL17612053 0.94 ALOX5 (0.43) ALOX5PRKDCPTGES2GGPS1TSPO
SCHEMBL16850650 0.92 ALOX5 (0.43) ALOX5PRKDCPTGES2GGPS1TSPO
SCHEMBL16850662 0.92 ALOX5 (0.44) ALOX5PRKDCPTGES2GGPS1TSPO
SCHEMBL16850815 0.92 TSPO (0.37) PRKDCMMP12MMP13TSPOPLA2G2A
SCHEMBL16850814 0.92 TSPO (0.37) PRKDCMMP12MMP13TSPOPLA2G2A
SCHEMBL16850749 0.92 ALOX5 (0.41) ALOX5PRKDCPTGES2GGPS1TSPO
SCHEMBL21453817 0.91 ALOX5 (0.42) ALOX5PRKDCPTGES2GGPS1TSPO
SCHEMBL16850752 0.91 ALOX5 (0.42) ALOX5PRKDCPTGES2GGPS1TSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9293714-B2 Material for organic electroluminescence device and organic electroluminescence device using the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-03-22 US disclosed
US-9293714-B2 Material for organic electroluminescence device and organic electroluminescence device using the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-03-22 US disclosed
US-20150179950-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-25 US disclosed