SCHEMBL17612092

SCHEMBL17612092

c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)c5cccc7c8ccccc8n6c75)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
TSPO P30536 1/20 0.36
GGPS1 O95749 1/20 0.36
PRKDC P78527 8/20 0.36
PTGES2 Q9H7Z7 1/20 0.36
PLA2G2A P14555 3/20 0.36
PLA2G4A P47712 3/20 0.36
PLA2G10 O15496 1/20 0.34
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
ATM Q13315 1/20 0.32
PIK3CD O00329 2/20 0.32
PIK3CA P42336 2/20 0.32
PIK3CB P42338 2/20 0.32
PIK3CG P48736 2/20 0.32
KDM4E B2RXH2 1/20 0.32
PDE2A O00408 1/20 0.32
PIK3C2A O00443 1/20 0.32
PIK3R2 O00459 1/20 0.32
PIK3C2B O00750 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
SCHEMBL17612053 1.00 ALOX5 (0.43) ALOX5TSPOGGPS1PRKDCPTGES2
SCHEMBL16850662 0.98 ALOX5 (0.44) ALOX5TSPOGGPS1PRKDCPTGES2
SCHEMBL16850650 0.96 ALOX5 (0.43) ALOX5TSPOGGPS1PRKDCPTGES2
SCHEMBL21453817 0.95 ALOX5 (0.42) ALOX5TSPOGGPS1PRKDCPTGES2
SCHEMBL16850752 0.95 ALOX5 (0.42) ALOX5TSPOGGPS1PRKDCPTGES2
SCHEMBL16850822 0.94 ALOX5 (0.39) ALOX5TSPOGGPS1PRKDCPTGES2
SCHEMBL16842784 0.94 ALOX5 (0.43) ALOX5GGPS1PRKDCPTGES2PLA2G2A
SCHEMBL16842791 0.94 ALOX5 (0.43) ALOX5GGPS1PRKDCPTGES2PLA2G2A
SCHEMBL16852037 0.94 ALOX5 (0.44) ALOX5GGPS1PRKDCPTGES2PLA2G2A
SCHEMBL16850699 0.93 ALOX5 (0.39) ALOX5TSPOGGPS1PRKDCPTGES2

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 2 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