SCHEMBL5666385

SCHEMBL5666385

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

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.68
P2RY2 P41231 3/20 0.55
P2RY4 P51582 3/20 0.55
P2RY6 Q15077 2/20 0.55
LMNA P02545 3/20 0.50
PDE3A Q14432 3/20 0.50
CACNA1F O60840 2/20 0.50
ALB P02768 2/20 0.50
MAPT P10636 2/20 0.50
CACNA1D Q01668 2/20 0.50
CACNA1S Q13698 2/20 0.50
CACNA1C Q13936 2/20 0.50
ADRB1 P08588 1/20 0.50
DNMT1 P26358 1/20 0.50
THRB P10828 1/20 0.49
MTOR P42345 1/20 0.49
MDM2 Q00987 1/20 0.49
NCOA1 Q15788 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
POLG P54098 1/20 0.47

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
SCHEMBL3424606 1.00 POLB (0.68) POLBP2RY2P2RY4P2RY6LMNA
SCHEMBL3200090 0.91 POLB (0.68) POLBP2RY2P2RY4P2RY6LMNA
SCHEMBL1939479 0.91 POLB (0.68) POLBP2RY2P2RY4P2RY6LMNA
SCHEMBL15617962 0.91 POLB (0.68) POLBP2RY2P2RY4P2RY6LMNA
SCHEMBL25456568 0.89 POLB (0.67) POLBP2RY2P2RY4P2RY6LMNA
SCHEMBL127180 0.89 POLB (0.67) POLBP2RY2P2RY4P2RY6LMNA
SCHEMBL16359976 0.89 POLB (0.67) POLBP2RY2P2RY4P2RY6LMNA
SCHEMBL15798554 0.89 POLB (0.67) POLBP2RY2P2RY4P2RY6LMNA
SCHEMBL992473 0.89 POLB (0.67) POLBP2RY2P2RY4P2RY6LMNA
SCHEMBL19717860 0.89 POLB (0.67) POLBP2RY2P2RY4P2RY6LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060141523-A1 Integrated method for PCR cleanup and oligonucleotide removal APPLERA CORPORATION (US) 2006-06-29 US disclosed
EP-1579015-A4 METHOD FOR PCR CLEANUP AND OLIGONUCLEOTIDE REMOVAL APPLERA CORP (US) 2006-06-21 EP disclosed
EP-1579015-A2 METHOD FOR PCR CLEANUP AND OLIGONUCLEOTIDE REMOVAL Applera Corporation (US) 2005-09-28 EP disclosed
EP-1579015-A3 METHOD FOR PCR CLEANUP AND OLIGONUCLEOTIDE REMOVAL Applera Corporation (US) 2005-08-25 EP disclosed
US-20040023220-A1 Integrated method for PCR cleanup and oligonucleotide removal APPLIED BIOSYSTEMS, LLC 2004-02-05 US disclosed
WO-2004009851-A2 METHOD FOR PCR CLEANUP AND OLIGONUCLEOTIDE REMOVAL APPLERA CORPORATION (US) 2004-01-29 WO disclosed