SCHEMBL18505331

SCHEMBL18505331

c1ccc(-c2ccc3c(c2)c2c(ccc4c5ccccc5n(-c5ccccc5)c42)n3-c2ccc(-c3cccc4c3oc3ccccc34)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.41
PRKDC P78527 4/20 0.36
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GGPS1 O95749 1/20 0.34
PTGES2 Q9H7Z7 1/20 0.32
PLA2G2A P14555 1/20 0.32
PLA2G4A P47712 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
BRCA1 P38398 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP17A1 P05093 1/20 0.31
CYP19A1 P11511 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 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
SCHEMBL18505322 1.00 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL25015646 0.97 ALOX5 (0.41) ALOX5PRKDCGGPS1PTGES2PLA2G2A
SCHEMBL18505332 0.96 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505321 0.96 ALOX5 (0.41) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505320 0.95 ALOX5 (0.40) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505327 0.95 ALOX5 (0.40) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505328 0.95 ALOX5 (0.40) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505314 0.95 ALOX5 (0.40) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505333 0.95 ALOX5 (0.40) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL18505319 0.95 ALOX5 (0.40) 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