SCHEMBL6980800

SCHEMBL6980800

Nc1ccn(C2CO[CH]O2)c(=O)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.51
PDE3A Q14432 3/20 0.51
CACNA1F O60840 2/20 0.51
ALB P02768 2/20 0.51
MAPT P10636 2/20 0.51
CACNA1D Q01668 2/20 0.51
CACNA1S Q13698 2/20 0.51
CACNA1C Q13936 2/20 0.51
THRB P10828 1/20 0.44
MTOR P42345 1/20 0.44
MDM2 Q00987 1/20 0.44
NCOA1 Q15788 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
PDE4D Q08499 1/20 0.41
SLC29A1 Q99808 1/20 0.41
POLG P54098 2/20 0.40
POLB P06746 2/20 0.40
FGFR1 P11362 2/20 0.38
NT5E P21589 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL7087937 0.77 LMNA (0.50) LMNAPDE3ACACNA1FALBMAPT
SCHEMBL10015798 0.75 LMNA (0.51) LMNAPDE3ACACNA1FALBMAPT
SCHEMBL31206610 0.75 LMNA (0.51) LMNAPDE3ACACNA1FALBMAPT
SCHEMBL17542420 0.75 LMNA (0.51) LMNAPDE3ACACNA1FALBMAPT
SCHEMBL22941496 0.75 LMNA (0.51) LMNAPDE3ACACNA1FALBMAPT
SCHEMBL31206933 0.74 KMT2A (0.64) LMNAPDE3ACACNA1FALBMAPT
SCHEMBL9840320 0.74 KMT2A (0.64) LMNAPDE3ACACNA1FALBMAPT
SCHEMBL27538427 0.74 LMNA (0.50) LMNAPDE3ACACNA1FALBMAPT
Magnesium SCHEMBL31206645 0.74 LMNA (0.50) LMNAPDE3ACACNA1FALBMAPT
Calcium SCHEMBL31206840 0.74 LMNA (0.50) LMNAPDE3ACACNA1FALBMAPT

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-1324997-A2 DIOXOLANE ANALOGS FOR IMPROVED INTER-CELLULAR DELIVERY Shire Biochem Inc. (CA) 2003-07-09 EP disclosed
WO-2002030922-A2 DIOXOLANE ANALOGS FOR IMPROVED INTER-CELLULAR DELIVERY SHIRE BIOCHEM INC. (CA) 2002-04-18 WO disclosed