SCHEMBL18960962

SCHEMBL18960962

c1ccc2c(c1)Oc1cccc(-c3cc(-c4cccc5c4oc4ccccc45)nc(-c4ccc5c6ccccc6c6ccccc6c5c4)n3)c1O2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.42
PRKDC P78527 5/20 0.35
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
GGPS1 O95749 1/20 0.33
PTPRF P10586 4/20 0.32
PTPN2 P17706 4/20 0.32
PTPN1 P18031 4/20 0.32
MAPT P10636 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CHEK2 O96017 1/20 0.32
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
PTGES2 Q9H7Z7 1/20 0.31
ATM Q13315 1/20 0.31
NPC1 O15118 2/20 0.30
AHR P35869 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL18960942 0.91 CHEK2 (0.35) ALOX5PTPRFPTPN2PTPN1MAPT
SCHEMBL18960954 0.90 ALOX5 (0.43) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL18960937 0.85 CHEK2 (0.36) ALOX5MAPTMEN1KMT2ACHEK2
SCHEMBL18960958 0.84 MEN1 (0.40) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL25049892 0.83 ALOX5 (0.46) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL18960932 0.83 MEN1 (0.40) MAPTMEN1KMT2AKDM4EALDH1A1
SCHEMBL18960963 0.83 ALOX5 (0.38) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL18961064 0.82 ALOX5 (0.48) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL25050238 0.82 ALOX5 (0.45) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL25050591 0.82 ALOX5 (0.45) ALOX5PRKDCPIK3CDPIK3CBGGPS1

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-20170170405-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-15 US disclosed
US-20170170405-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-15 US disclosed