SCHEMBL9309775

SCHEMBL9309775

Nc1ccn(C2CCC(CO)C2CO)c(=O)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3A Q14432 3/20 0.52
LMNA P02545 3/20 0.52
CACNA1F O60840 2/20 0.52
ALB P02768 2/20 0.52
MAPT P10636 2/20 0.52
CACNA1D Q01668 2/20 0.52
CACNA1S Q13698 2/20 0.52
CACNA1C Q13936 2/20 0.52
PDE4D Q08499 1/20 0.48
SLC29A1 Q99808 1/20 0.48
THRB P10828 1/20 0.48
MTOR P42345 1/20 0.48
MDM2 Q00987 1/20 0.48
NCOA1 Q15788 1/20 0.48
NCOA3 Q9Y6Q9 1/20 0.48
POLG P54098 2/20 0.37
NT5E P21589 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 1/20 0.35
ST6GAL1 P15907 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
SCHEMBL9470739 0.90 LMNA (0.52) PDE3ALMNACACNA1FALBMAPT
SCHEMBL8541689 0.88 LMNA (0.50) PDE3ALMNACACNA1FALBMAPT
SCHEMBL8797148 0.88 LMNA (0.50) PDE3ALMNACACNA1FALBMAPT
SCHEMBL8541693 0.88 LMNA (0.50) PDE3ALMNACACNA1FALBMAPT
SCHEMBL8797151 0.88 LMNA (0.50) PDE3ALMNACACNA1FALBMAPT
SCHEMBL9471195 0.88 LMNA (0.50) PDE3ALMNACACNA1FALBMAPT
SCHEMBL10421043 0.88 LMNA (0.50) PDE3ALMNACACNA1FALBMAPT
SCHEMBL9311419 0.82 LMNA (0.54) PDE3ALMNACACNA1FALBMAPT
SCHEMBL10468438 0.80 LMNA (0.55) PDE3ALMNACACNA1FALBMAPT
SCHEMBL9471029 0.80 LMNA (0.55) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5374625-A Bis/hydroxymethyl/cycloalkyl derivatives; viricides NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1994-12-20 US disclosed
EP-0468352-A2 Novel nucleic acid derivatives Nippon Kayaku Kabushiki Kaisha (JP) 1992-01-29 EP disclosed