SCHEMBL9912940

SCHEMBL9912940

Cc1ccc(N(c2ccc(C)cc2)c2cccc(-n3c4ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc4c4cc(N(c5ccc(C)cc5)c5ccc(C)cc5)ccc43)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
KDM4E B2RXH2 5/20 0.33
MAPT P10636 4/20 0.33
GAA P10253 3/20 0.33
APP P05067 1/20 0.33
HTR2C P28335 1/20 0.32
GFER P55789 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.31
LMNA P02545 2/20 0.31
HPGD P15428 2/20 0.31
HTT P42858 1/20 0.31
ALDH1A1 P00352 4/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALOX15 P16050 2/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
TP53 P04637 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
SCHEMBL9912915 0.97 KDM4E (0.37) POLBKDM4EMAPTGAAAPP
SCHEMBL9912939 0.91 TDP1 (0.35) GAAGFERL3MBTL1SMN1; SMN2HPGD
SCHEMBL9912926 0.91 HTT (0.39) KDM4EMAPTGAAAPPHTR2C
SCHEMBL9912920 0.90 SMN1; SMN2 (0.37) KDM4EMAPTGAAAPPGFER
SCHEMBL15468954 0.89 KDM4E (0.44) POLBKDM4EMAPTGAAAPP
SCHEMBL9912922 0.89 KDM4E (0.42) KDM4EMAPTGAAAPPGFER
SCHEMBL9912945 0.88 APP (0.37) POLBKDM4EMAPTGAAAPP
SCHEMBL9912891 0.88 APP (0.41) POLBKDM4EMAPTGAAAPP
SCHEMBL12249799 0.88 APP (0.41) POLBKDM4EMAPTGAAAPP
SCHEMBL9912971 0.88 APP (0.41) POLBKDM4EMAPTGAAAPP

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-8198801-B2 Materials for injecting or transporting holes and organic electroluminescence devices using the same LG CHEM, LTD. (KR) 2012-06-12 US disclosed
US-8198801-B2 Materials for injecting or transporting holes and organic electroluminescence devices using the same LG CHEM, LTD. (KR) 2012-06-12 US disclosed