SCHEMBL9328007

SCHEMBL9328007

Nc1ccn([C@H]2C[C@H](OP(=O)(O)O)[C@@H](COCO)O2)c(=O)n1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
POLG P54098 2/20 0.48
LMNA P02545 3/20 0.47
CACNA1F O60840 2/20 0.47
ALB P02768 2/20 0.47
MAPT P10636 2/20 0.47
CACNA1D Q01668 2/20 0.47
CACNA1S Q13698 2/20 0.47
CACNA1C Q13936 2/20 0.47
PDE3A Q14432 2/20 0.47
P2RY2 P41231 3/20 0.46
P2RY4 P51582 3/20 0.46
P2RY6 Q15077 2/20 0.46
THRB P10828 1/20 0.43
MTOR P42345 1/20 0.43
MDM2 Q00987 1/20 0.43
NCOA1 Q15788 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43

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
SCHEMBL6038227 0.91 POLG (0.57) POLBPOLGLMNACACNA1FALB
SCHEMBL5038295 0.90 POLB (0.62) POLBPOLGLMNACACNA1FALB
SCHEMBL4303303 0.90 POLB (0.57) POLBPOLGLMNACACNA1FALB
SCHEMBL16312542 0.90 POLB (0.62) POLBPOLGLMNACACNA1FALB
SCHEMBL10228314 0.89 POLB (0.56) POLBPOLGLMNACACNA1FALB
SCHEMBL10331118 0.89 POLB (0.56) POLBPOLGLMNACACNA1FALB
SCHEMBL6522346 0.89 POLB (0.56) POLBPOLGLMNACACNA1FALB
SCHEMBL17027928 0.89 POLB (0.56) POLBPOLGLMNACACNA1FALB
SCHEMBL1970390 0.88 POLB (0.57) POLBPOLGLMNACACNA1FALB
SCHEMBL1970398 0.88 POLB (0.57) POLBPOLGLMNACACNA1FALB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3049814-A1 METHOD Isis Innovation Limited (GB) 2016-08-03 EP disclosed
WO-2015040423-A1 METHOD ISIS INNOVATION LIMITED (GB) 2015-03-26 WO disclosed
EP-0133473-B1 In vivo labelling of polynucleotide sequences ENZO BIOCHEM INC (US) 1994-03-23 EP disclosed
US-4987065-A GENETIC ENGINEERING ENZO BIOCHEM, INC. (US) 1991-01-22 US disclosed
EP-0133473-A2 In vivo labelling of polynucleotide sequences ENZO BIOCHEM, INC. (US) 1985-02-27 EP disclosed