SCHEMBL1970398

SCHEMBL1970398

NC[C@H]1O[C@@H](n2ccc(N)nc2=O)CC1OP(=O)(O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.57
POLG P54098 2/20 0.50
LMNA P02545 3/20 0.48
PDE3A Q14432 3/20 0.48
CACNA1F O60840 2/20 0.48
ALB P02768 2/20 0.48
MAPT P10636 2/20 0.48
CACNA1D Q01668 2/20 0.48
CACNA1S Q13698 2/20 0.48
CACNA1C Q13936 2/20 0.48
P2RY2 P41231 3/20 0.47
P2RY4 P51582 3/20 0.47
P2RY6 Q15077 2/20 0.47
THRB P10828 1/20 0.45
MTOR P42345 1/20 0.45
MDM2 Q00987 1/20 0.45
NCOA1 Q15788 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
PDE4D Q08499 1/20 0.42
SLC29A1 Q99808 1/20 0.42

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
SCHEMBL1970390 1.00 POLB (0.57) POLBPOLGLMNAPDE3ACACNA1F
SCHEMBL6522346 0.92 POLB (0.56) POLBPOLGLMNAPDE3ACACNA1F
SCHEMBL10331118 0.92 POLB (0.56) POLBPOLGLMNAPDE3ACACNA1F
SCHEMBL10228314 0.92 POLB (0.56) POLBPOLGLMNAPDE3ACACNA1F
SCHEMBL4303303 0.90 POLB (0.57) POLBPOLGLMNAPDE3ACACNA1F
SCHEMBL16312542 0.90 POLB (0.62) POLBPOLGLMNAPDE3ACACNA1F
SCHEMBL5038295 0.90 POLB (0.62) POLBPOLGLMNAPDE3ACACNA1F
SCHEMBL17027928 0.89 POLB (0.56) POLBPOLGLMNAPDE3ACACNA1F
SCHEMBL9328007 0.88 POLB (0.55) POLBPOLGLMNAPDE3ACACNA1F
SCHEMBL18102345 0.86 POLB (0.58) POLBPOLGP2RY2P2RY4P2RY6

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-1740719-B1 METHOD FOR DE NOVO DETECTION OF SEQUENCES IN NUCLEIC ACIDS:TARGET SEQUENCING BY FRAGMENTATION UNIV BOSTON (US) 2011-06-22 EP disclosed