SCHEMBL23808317

SCHEMBL23808317

Nc1ccn([C@H]2CC[C@@](F)(CO)O2)c(=O)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3A Q14432 3/20 0.51
LMNA P02545 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
PDE4D Q08499 1/20 0.50
SLC29A1 Q99808 1/20 0.50
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
POLG P54098 2/20 0.41
POLB P06746 1/20 0.39
POLA1 P09884 2/20 0.37
NT5E P21589 1/20 0.35
ABL1 P00519 1/20 0.35

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
SCHEMBL9548743 0.85 PDE3A (0.53) PDE3ALMNACACNA1FALBMAPT
SCHEMBL13843893 0.84 PDE3A (0.52) PDE3ALMNACACNA1FALBMAPT
SCHEMBL13674371 0.83 PDE3A (0.49) PDE3ALMNACACNA1FALBMAPT
SCHEMBL20879502 0.83 PDE3A (0.49) PDE3ALMNACACNA1FALBMAPT
SCHEMBL12840917 0.83 PDE3A (0.51) PDE3ALMNACACNA1FALBMAPT
SCHEMBL12060941 0.82 PDE3A (0.48) PDE3ALMNACACNA1FALBMAPT
SCHEMBL20879403 0.82 PDE3A (0.50) PDE3ALMNACACNA1FALBMAPT
SCHEMBL20117261 0.81 PDE3A (0.49) PDE3ALMNACACNA1FALBMAPT
SCHEMBL10083556 0.81 PDE3A (0.49) PDE3ALMNACACNA1FALBMAPT
SCHEMBL17533990 0.81 PDE3A (0.47) PDE3ALMNACACNA1FALBMAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2981542-B1 2',4'-FLUORO NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS LLC (US) 2021-09-15 EP disclosed