SCHEMBL19626192

SCHEMBL19626192

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-n5c6ccccc6c6cc(-c7ccc(-c8ccc9sc%10ccccc%10c9c8)cc7)ccc65)c4)n3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTGER4 P35408 1/20 0.34
LIMK1 P53667 1/20 0.33
TSPO P30536 1/20 0.33
PDE10A Q9Y233 1/20 0.32
ROCK1 Q13464 1/20 0.32
CYP1A2 P05177 1/20 0.32
NPY5R Q15761 1/20 0.32
GPR3 P46089 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
ABCG2 Q9UNQ0 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
SCHEMBL19626194 1.00 PIM3 (0.37) PIM3KDM4EATML3MBTL1PTGER4
SCHEMBL18505404 1.00 PIM3 (0.37) PIM3KDM4EATML3MBTL1PTGER4
SCHEMBL15786080 0.99 KDM4E (0.38) PIM3KDM4EATML3MBTL1PTGER4
SCHEMBL19845463 0.98 PIM3 (0.37) PIM3KDM4EATML3MBTL1PTGER4
SCHEMBL15786079 0.98 KDM4E (0.37) PIM3KDM4EATML3MBTL1PTGER4
SCHEMBL24152727 0.98 KDM4E (0.39) PIM3KDM4EATML3MBTL1LIMK1
SCHEMBL15785958 0.97 KDM4E (0.36) PIM3KDM4EATML3MBTL1PTGER4
SCHEMBL15786125 0.97 KDM4E (0.36) PIM3KDM4EATML3MBTL1PTGER4
SCHEMBL19845460 0.97 PIM3 (0.37) PIM3KDM4EATML3MBTL1PTGER4
SCHEMBL22023754 0.97 KDM4E (0.41) PIM3KDM4EATML3MBTL1PTGER4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200332183-A9 A NOVEL COMBINATION OF A HOST COMPOUND AND A DOPANT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2020-10-22 US disclosed
US-20170335181-A1 A NOVEL COMBINATION OF A HOST COMPOUND AND A DOPANT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2017-11-23 US disclosed
US-20170335181-A1 A NOVEL COMBINATION OF A HOST COMPOUND AND A DOPANT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2017-11-23 US disclosed