SCHEMBL887207

SCHEMBL887207

Nc1nc(SCC(=O)O)c2[nH]cnc2n1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 2/20 0.70
CYP1A2 P05177 7/20 0.67
CYP2C19 P33261 6/20 0.67
CYP3A4 P08684 5/20 0.67
PIN1 Q13526 2/20 0.63
POLB P06746 1/20 0.63
CYP2D6 P10635 4/20 0.61
CYP2C9 P11712 3/20 0.61
ALDH1A1 P00352 2/20 0.61
HPGD P15428 2/20 0.61
HIF1A Q16665 2/20 0.61
TOP2A P11388 1/20 0.61
NUDT1 P36639 1/20 0.61
HSD17B10 Q99714 1/20 0.61
MAP3K5 Q99683 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.57
DPP4 P27487 1/20 0.51
MGMT P16455 4/20 0.50
PDPK1 O15530 1/20 0.50
GDA Q9Y2T3 1/20 0.50

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
SCHEMBL9443763 0.88 CYP1A2 (0.66) ENPP1CYP1A2CYP2C19CYP3A4PIN1
SCHEMBL24846433 0.86 CYP1A2 (0.79) ENPP1CYP1A2CYP2C19CYP3A4PIN1
SCHEMBL24846480 0.83 ENPP1 (1.00) ENPP1CYP1A2CYP2C19CYP3A4PIN1
SCHEMBL12920817 0.81 CYP1A2 (1.00) ENPP1CYP1A2CYP2C19CYP3A4PIN1
SCHEMBL24846493 0.81 ENPP1 (0.73) ENPP1CYP1A2CYP2C19CYP3A4PIN1
SCHEMBL16758710 0.80 MAP3K5 (0.69) ENPP1CYP1A2CYP2C19CYP3A4PIN1
SCHEMBL24846950 0.79 ENPP1 (0.68) ENPP1CYP1A2CYP2C19CYP3A4PIN1
SCHEMBL24846498 0.79 ENPP1 (0.82) ENPP1CYP1A2CYP2C19CYP3A4PIN1
SCHEMBL24846405 0.79 ENPP1 (0.62) ENPP1CYP1A2CYP2C19CYP3A4PIN1
SCHEMBL24847411 0.79 ENPP1 (0.65) ENPP1CYP1A2CYP2C19CYP3A4PIN1

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8486638-B2 Method for fast detection and identification of micro-organisms CHECK-POINTS HOLDING B.V. (NL) 2013-07-16 US disclosed
EP-2344668-B1 METHOD FOR FAST DETECTION AND IDENTIFICATION OF MICRO-ORGANISMS CHECK POINTS HOLDING B V (NL) 2012-12-05 EP disclosed
US-20110287962-A1 METHOD FOR FAST DETECTION AND IDENTIFICATION OF MICRO-ORGANISMS CHECK-POINTS HOLDING B.V. (NL) 2011-11-24 US disclosed
EP-2344668-A1 METHOD FOR FAST DETECTION AND IDENTIFICATION OF MICRO-ORGANISMS Check-Points Holding B.V. (NL) 2011-07-20 EP disclosed
WO-2010049489-A1 METHOD FOR FAST DETECTION AND IDENTIFICATION OF MICRO-ORGANISMS CHECK-POINTS HOLDING B.V. (NL) 2010-05-06 WO disclosed
EP-1583842-A4 METHODS FOR THE ELECTROCHEMICAL DETECTION OF MULTIPLE TARGET COMPOUNDS UNIV NORTH CAROLINA (US) 2007-07-04 EP disclosed
US-7202028-B2 Methods for the electrochemical detection of multiple target compounds THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2007-04-10 US disclosed
US-20060292624-A1 Methods for the electrochemical detection of multiple target compounds ROCHE MOLECULAR SYSTEMS, INC. 2006-12-28 US disclosed
US-7049068-B2 Microelectronic device for electrochemical detection of nucleic acid hybridization THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2006-05-23 US disclosed
EP-1185692-B1 MONOLAYER AND ELECTRODE FOR DETECTING A LABEL-BEARING TARGET AND METHOD OF USE THEREOF UNIV NORTH CAROLINA (US) 2005-12-07 EP disclosed
WO-2000065099-A1 MONOLAYER AND ELECTRODE FOR DETECTING A LABEL-BEARING TARGET AND METHOD OF USE THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-11-02 WO disclosed
US-6132971-A APPARATUS FOR ELECTROCHEMICAL DETECTION OF A BINDING PAIR; FOR THE EFFICIENT AND ACCURATE DETECTION OF MUTATIONS IN NUCLEOTIDE SEQUENCES THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-10-17 US disclosed
US-6127127-A Monolayer and electrode for detecting a label-bearing target and method of use thereof THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-10-03 US disclosed
WO-2000055366-A1 ELECTROPOLYMERIZABLE FILM, AND METHOD OF MAKING AND USE THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-09-21 WO disclosed
US-5968745-A ELECTRODE OF SUBSTRATE HAVING ELECTROCONDUCTIVE WORKING SURFACE AND A NONCONDUCTIVE OUTER POLYMER LAYER WHERE PROBES CAN BE ATTACHED HAVING MICROFLUIDIC REACTION OPENINGS FOR TRANSITION METAL COMPLEX TO TRANSFER ELECTRONS TO SURFACE THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1999-10-19 US disclosed
US-5871918-A DNA AND RNA HYBRIDIZATION DETECTION BY REACTION WITH TRANSITION METAL COMPLEX FOR OXIDATION-REDUCTION REACTION THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1999-02-16 US disclosed
EP-0871773-A2 ELECTROCHEMICAL DETECTION OF NUCLEIC ACID HYBRIDIZATION UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1998-10-21 EP disclosed
CN-1192249-A Electrochemical detection of nucleic acid hybridization UNIV NORTH CAROLINA (US) 1998-09-02 CN disclosed
WO-1997001646-A2 ELECTROCHEMICAL DETECTION OF NUCLEIC ACID HYBRIDIZATION THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1997-01-16 WO disclosed
US-5213972-A Production of thymidine and deoxyuridine, intermediates for AZT CHEMGEN CORPORATION (US) 1993-05-25 US disclosed