SCHEMBL18505085

SCHEMBL18505085

c1ccc2c(c1)cc(-n1c3ccccc3c3cc4c5ccccc5n(-c5ccc(-c6cccc7c6sc6ccccc67)cc5)c4cc31)c1ccccc12

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
PRKDC P78527 5/20 0.36
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PARP14 Q460N5 1/20 0.32
PIK3CD O00329 2/20 0.31
PIK3CB P42338 2/20 0.31
BRD4 O60885 1/20 0.31
PIK3CA P42336 1/20 0.31
MTOR P42345 1/20 0.31
PIK3CG P48736 1/20 0.31
KCNH2 Q12809 1/20 0.31
BRDT Q58F21 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
SCHEMBL18505086 0.94 ALOX5 (0.44) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505082 0.90 ALOX5 (0.43) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505077 0.89 ALOX5 (0.44) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505069 0.89 ALOX5 (0.46) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505087 0.89 ALOX5 (0.42) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL780864 0.88 ALOX5 (0.50) ALOX5PRKDCL3MBTL1PARP14PIK3CD
SCHEMBL780768 0.88 ALOX5 (0.50) ALOX5PRKDCL3MBTL1PARP14PIK3CD
SCHEMBL15893257 0.88 ALOX5 (0.49) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL15759580 0.88 ALOX5 (0.49) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL781165 0.87 ALOX5 (0.47) 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