SCHEMBL9968148

SCHEMBL9968148

CC(C)(C)c1ccc2c(n1)c1cc(C(C)(C)c3ccc4c(c3)c3nc(C(C)(C)C)ccc3n4-c3ccccc3)ccc1n2-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPK1 P28482 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CASP1 P29466 2/20 0.38
CASP7 P55210 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
TSHR P16473 1/20 0.38
ATM Q13315 1/20 0.37
NR1I2 O75469 1/20 0.35
AHR P35869 1/20 0.35
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAT2A P31153 2/20 0.34
GRN P28799 1/20 0.33
SORT1 Q99523 1/20 0.33
HCRTR1 O43613 2/20 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
SCHEMBL9968144 0.90 KDM4E (0.38) KDM4EALDH1A1MEN1KMT2AMAPK1
SCHEMBL9968138 0.83 MEN1 (0.40) KDM4EALDH1A1MEN1KMT2AMAPK1
SCHEMBL9968166 0.80 L3MBTL1 (0.40) KDM4EALDH1A1MEN1KMT2AMAPK1
SCHEMBL9968140 0.78 ALDH1A1 (0.40) KDM4EALDH1A1MEN1KMT2AMAPK1
SCHEMBL9968196 0.77 L3MBTL1 (0.34) KDM4EALDH1A1MEN1KMT2AMAPK1
SCHEMBL13146817 0.76 L3MBTL1 (0.52) KDM4EALDH1A1MEN1KMT2AMAPK1
SCHEMBL31621190 0.76 L3MBTL1 (0.52) KDM4EALDH1A1MEN1KMT2AMAPK1
SCHEMBL9968184 0.76 L3MBTL1 (0.37) KDM4EALDH1A1MEN1KMT2AMAPK1
SCHEMBL20277355 0.76 ABCG2 (0.36) MEN1KMT2A
SCHEMBL13589177 0.75 ESR1 (0.44) KDM4EALDH1A1L3MBTL1ATMPPARG

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