SCHEMBL15317339

SCHEMBL15317339

c1ccc(-c2ccc3c(c2)c2cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc2n3-c2ccc3sc4cccnc4c3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.39
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ROCK1 Q13464 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
TSPO P30536 1/20 0.32
HDAC4 P56524 1/20 0.32
NPY5R Q15761 1/20 0.32
PIM3 Q86V86 2/20 0.32
PTGER4 P35408 1/20 0.32
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
RAC2 P15153 1/20 0.31
RAC3 P60763 1/20 0.31
CDC42 P60953 1/20 0.31
RAC1 P63000 1/20 0.31
FEN1 P39748 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
SCHEMBL15317338 0.99 KDM4E (0.39) LIMK1KDM4EATML3MBTL1ROCK1
SCHEMBL15317323 0.98 KDM4E (0.40) LIMK1KDM4EATML3MBTL1ROCK1
SCHEMBL15317384 0.97 KDM4E (0.38) LIMK1KDM4EATML3MBTL1ROCK1
SCHEMBL15317326 0.97 LIMK1 (0.41) LIMK1KDM4EATML3MBTL1ROCK1
SCHEMBL15317330 0.97 ATM (0.41) LIMK1KDM4EATML3MBTL1ROCK1
SCHEMBL15317325 0.95 KDM4E (0.38) LIMK1KDM4EATML3MBTL1ALDH1A1
SCHEMBL15317336 0.94 LIMK1 (0.38) LIMK1KDM4EATML3MBTL1ROCK1
SCHEMBL16304719 0.93 LIMK1 (0.35) LIMK1KDM4EATML3MBTL1ROCK1
SCHEMBL18232834 0.92 LIMK1 (0.39) LIMK1KDM4EATML3MBTL1ROCK1
SCHEMBL15317390 0.92 KDM4E (0.34) LIMK1KDM4EATML3MBTL1NPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9923151-B2 Material for organic electroluminescent elements, and organic electroluminescent element using same IDEMITSU KOSAN CO., LTD. (JP) 2018-03-20 US disclosed
US-9923151-B2 Material for organic electroluminescent elements, and organic electroluminescent element using same IDEMITSU KOSAN CO., LTD. (JP) 2018-03-20 US disclosed
US-20130270540-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2013-10-17 US disclosed
US-20130270540-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2013-10-17 US disclosed