SCHEMBL17989796

SCHEMBL17989796

c1ccc(-n2c3cc4c5ccccc5n(-c5cccc6ccccc56)c4cc3c3c4ccccc4ccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
ATM Q13315 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ALDH1A1 P00352 5/20 0.37
JAK2 O60674 1/20 0.37
JAK3 P52333 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
TSHR P16473 2/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
KDR P35968 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
PTGES O14684 1/20 0.32
GSR P00390 1/20 0.32
POLB P06746 2/20 0.32
HPGD P15428 1/20 0.32
MEN1 O00255 1/20 0.32
BRCA1 P38398 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
SCHEMBL27453985 0.95 KDM4E (0.46) KDM4EATML3MBTL1ALDH1A1JAK2
SCHEMBL17989766 0.93 KDM4E (0.56) KDM4EATML3MBTL1ALDH1A1JAK2
SCHEMBL17990348 0.92 KDM4E (0.44) KDM4EATML3MBTL1ALDH1A1JAK2
SCHEMBL26495881 0.92 KDM4E (0.46) KDM4EATML3MBTL1ALDH1A1JAK2
SCHEMBL17989784 0.92 KDM4E (0.46) KDM4EATML3MBTL1ALDH1A1JAK2
SCHEMBL17989792 0.92 KDM4E (0.46) KDM4EATML3MBTL1ALDH1A1JAK2
SCHEMBL17228159 0.92 KDM4E (0.58) KDM4EATML3MBTL1ALDH1A1TDP1
SCHEMBL17228188 0.90 KDM4E (0.50) KDM4EATML3MBTL1ALDH1A1JAK2
SCHEMBL17915573 0.89 KDM4E (0.51) KDM4EATML3MBTL1ALDH1A1JAK2
SCHEMBL27216737 0.89 L3MBTL1 (0.43) KDM4EATML3MBTL1ALDH1A1JAK2

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-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed