SCHEMBL17809132

SCHEMBL17809132

c1ccc(-c2ccc(-c3cc(-c4ccccc4)cc(-c4cccc(-n5c6ccccc6c6ccc7c8ccccc8n(-c8cccc9c8oc8ccccc89)c7c65)c4)n3)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.32
AKT1 P31749 1/20 0.32
AKT2 P31751 1/20 0.32
AKT3 Q9Y243 1/20 0.32
KDM4E B2RXH2 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
PRKDC P78527 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.30
GAA P10253 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
SCHEMBL17809140 0.96 KDM4E (0.32) ALOX5KDM4EKMT2AALDH1A1MAPT
SCHEMBL17809131 0.94 ALOX5 (0.33) ALOX5AKT1AKT2AKT3KDM4E
SCHEMBL17809307 0.90 KDM4E (0.32) ALOX5KDM4EATML3MBTL1
SCHEMBL17809142 0.90 MAPT (0.34) ALOX5KDM4EKMT2AALDH1A1MAPT
SCHEMBL17809136 0.90 ALOX5 (0.33) ALOX5KDM4EKMT2AALDH1A1MAPT
SCHEMBL23203963 0.88 KDM4E (0.37) ALOX5KDM4EKMT2AALDH1A1PRKDC
SCHEMBL17809145 0.88 PRKDC (0.34) ALOX5KDM4EKMT2AALDH1A1MAPT
SCHEMBL17809148 0.88 MAPT (0.35) ALOX5KDM4EKMT2AALDH1A1MAPT
SCHEMBL26413259 0.87 KDM4E (0.36) ALOX5KDM4EKMT2AALDH1A1PRKDC
SCHEMBL17809385 0.87 KDM4E (0.33) KDM4EATML3MBTL1

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