SCHEMBL7008086

SCHEMBL7008086

[CH2]CS(=O)(=O)C(C)OC(c1ccccc1)(c1ccc(OC)cc1)c1ccc(OC)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
KIF11 P52732 9/20 0.40
KCNH2 Q12809 1/20 0.40
HSD11B1 P28845 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MMP1 P03956 2/20 0.37
MMP13 P45452 1/20 0.37
POLB P06746 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37

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
SCHEMBL8655114 0.81 KMT2A (0.42) KMT2AKIF11KCNH2HSD11B1HTT
SCHEMBL7010039 0.80 KMT2A (0.44) KMT2AKIF11KCNH2HSD11B1HTT
SCHEMBL28346610 0.76 KIF11 (0.44) KMT2AKIF11KCNH2ALDH1A1
SCHEMBL17173364 0.76 CA4 (0.46) KMT2AKIF11KCNH2ALDH1A1
SCHEMBL21562153 0.76 CA4 (0.46) KMT2AKIF11KCNH2ALDH1A1
SCHEMBL10495868 0.75 KIF11 (0.45) KMT2AKIF11KCNH2HSD11B1KDM4E
SCHEMBL8388886 0.73 SLC6A11 (0.44) KMT2AKIF11KCNH2HSD11B1CYP3A4
SCHEMBL8454432 0.73 KIF11 (0.45) KMT2AKIF11KCNH2
SCHEMBL3996218 0.71 KIF11 (0.49) KIF11KCNH2
SCHEMBL9306492 0.71 SLC6A11 (0.45) KMT2AKIF11HSD11B1CYP3A4

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
EP-0816368-B1 Chemical phoshorylation of oligonucleotides and reactants used therefor GLEN RES CORP (US) 2003-01-08 EP disclosed
EP-0816368-A1 Chemical phoshorylation of oligonucleotides and reactants used therefor Glen Research Corporation (US) 1998-01-07 EP disclosed