SCHEMBL17809131

SCHEMBL17809131

c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7cccc8c7oc7ccccc78)c6c54)cc3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
ALDH1A1 P00352 4/20 0.32
MAPT P10636 4/20 0.32
KDM4E B2RXH2 3/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MAPK1 P28482 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
HPGD P15428 2/20 0.32
ATM Q13315 1/20 0.32
PRKDC P78527 1/20 0.32
KMT2A Q03164 5/20 0.31
MEN1 O00255 4/20 0.31
POLB P06746 2/20 0.31
TSHR P16473 2/20 0.31
BRCA1 P38398 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MYC P01106 1/20 0.31
AKT1 P31749 1/20 0.31
AKT2 P31751 1/20 0.31
AKT3 Q9Y243 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
SCHEMBL17809132 0.94 ALOX5 (0.32) ALOX5ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL17809137 0.93 MAPT (0.35) ALOX5ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL17246061 0.93 KDM4E (0.34) ALOX5ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL17809140 0.92 KDM4E (0.32) ALOX5ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL17809129 0.92 MAPT (0.36) ALOX5ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL17809135 0.92 MAPT (0.36) ALOX5ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL17809136 0.91 ALOX5 (0.33) ALOX5ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL24357309 0.90 KDM4E (0.39) ALOX5ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL17809145 0.90 PRKDC (0.34) ALOX5ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL17809359 0.88 ALOX5 (0.32) ALOX5ALDH1A1MAPTKDM4EL3MBTL1

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-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed
US-20160163995-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-06-09 US disclosed