SCHEMBL18505069

SCHEMBL18505069

c1ccc2c(-c3ccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7ccc(-c8cccc9c8sc8ccccc89)cc7)c6cc54)cc3)cccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.46
PRKDC P78527 7/20 0.36
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CA12 O43570 3/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA9 Q16790 3/20 0.34
PARP14 Q460N5 1/20 0.34
F9 P00740 1/20 0.33
PIK3CD O00329 2/20 0.32
PIK3CB P42338 2/20 0.32
BRD4 O60885 1/20 0.32
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
PIK3CG P48736 1/20 0.32
KCNH2 Q12809 1/20 0.32
BRDT Q58F21 1/20 0.32
HDAC8 Q9BY41 1/20 0.32

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
SCHEMBL18505077 0.93 ALOX5 (0.44) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL10165703 0.93 ALOX5 (0.49) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL10165726 0.93 ALOX5 (0.49) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL15759580 0.92 ALOX5 (0.49) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505082 0.91 ALOX5 (0.43) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505084 0.91 ALOX5 (0.44) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505083 0.91 ALOX5 (0.44) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505075 0.91 ALOX5 (0.44) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505086 0.91 ALOX5 (0.44) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505040 0.91 ALOX5 (0.48) ALOX5PRKDCKDM4EATML3MBTL1

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-20230020540-A1 MULTI-COMPONENT HOST MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2023-01-19 US disclosed
US-20170047527-A1 MULTI-COMPONENT HOST MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-02-16 US disclosed
US-20170047527-A1 MULTI-COMPONENT HOST MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-02-16 US disclosed