SCHEMBL18505032

SCHEMBL18505032

c1ccc(-c2cccc(-c3ccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7ccc(-c8cccc9c8sc8ccccc89)cc7)c6cc54)cc3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.46
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PRKDC P78527 5/20 0.36
PARP14 Q460N5 1/20 0.34
HDAC4 P56524 1/20 0.34
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
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
LIMK1 P53667 2/20 0.32
PIM3 Q86V86 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
SCHEMBL18505029 0.98 ALOX5 (0.48) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505034 0.98 ALOX5 (0.48) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505035 0.97 ALOX5 (0.44) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505047 0.97 ALOX5 (0.44) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505044 0.97 ALOX5 (0.44) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL25015546 0.97 ALOX5 (0.44) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505045 0.97 ALOX5 (0.44) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505101 0.97 ALOX5 (0.48) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505051 0.96 ALOX5 (0.43) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL18505050 0.96 ALOX5 (0.43) ALOX5KDM4EATML3MBTL1PRKDC

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