SCHEMBL9968186

SCHEMBL9968186

CCC(C)(C)c1ccc2c(n1)c1ccccc1n2-c1cccc(-c2cccc(-n3c4ccccc4c4nc(C(C)(C)CC)ccc43)c2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
LMNA P02545 1/20 0.35
KDM4E B2RXH2 2/20 0.33
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
ATM Q13315 1/20 0.33
NR1H2 P55055 5/20 0.33
NR1H3 Q13133 5/20 0.33
RXFP1 Q9HBX9 1/20 0.32
PDE10A Q9Y233 1/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
NPC1 O15118 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
SCHEMBL9968184 0.88 L3MBTL1 (0.37) PTGER4L3MBTL1LMNAKDM4EMAPK13
SCHEMBL9968228 0.84 L3MBTL1 (0.36) PTGER4L3MBTL1LMNAKDM4EPDE4A
SCHEMBL9968204 0.83 TP53 (0.35) LMNAKDM4EMAPK14RXFP1ALDH1A1
SCHEMBL9968166 0.81 L3MBTL1 (0.40) PTGER4L3MBTL1LMNAKDM4EMAPK13
SCHEMBL9968185 0.80 L3MBTL1 (0.34) PTGER4L3MBTL1LMNAKDM4EATM
SCHEMBL9968221 0.79 KDM4E (0.36) PTGER4L3MBTL1KDM4EMAPK13MAPK12
SCHEMBL9968091 0.78 GPR3 (0.44) PTGER4L3MBTL1LMNAKDM4EALDH1A1
SCHEMBL8739894 0.78 KDM4E (0.40) L3MBTL1LMNAKDM4EPDE4APDE4B
SCHEMBL8739895 0.78 KDM4E (0.40) L3MBTL1LMNAKDM4EPDE4APDE4B
SCHEMBL10090531 0.75 KDM4E (0.40) L3MBTL1LMNAKDM4EPDE4APDE4B

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-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed
US-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed