SCHEMBL6944765

SCHEMBL6944765

Nc1nc2c(ncn2[C@H]2CC(OCc3ccccc3[N+](=O)[O-])[C@@H](CO)O2)c(=O)[nH]1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.46
SLC29A1 Q99808 2/20 0.45
HPGD P15428 1/20 0.43
P2RY2 P41231 1/20 0.41
P2RY4 P51582 1/20 0.41
P2RY6 Q15077 1/20 0.41
F2 P00734 1/20 0.41
STING1 Q86WV6 5/20 0.41
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
HPRT1 P00492 1/20 0.40
HINT1 P49773 1/20 0.40

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
SCHEMBL6944760 1.00 KDM4E (0.48) KDM4EPOLBSLC29A1HPGDP2RY2
SCHEMBL21563849 0.87 POLB (0.54) POLBP2RY2P2RY4P2RY6
SCHEMBL21545829 0.85 KDM4E (0.45) KDM4EPOLBSLC29A1HPGDF2
SCHEMBL21564047 0.85 KDM4E (0.45) KDM4EPOLBSLC29A1HPGDF2
SCHEMBL888197 0.85 POLB (0.57) POLBSLC29A1P2RY2P2RY4P2RY6
SCHEMBL21563856 0.84 SLC29A1 (0.49) POLBSLC29A1STING1
SCHEMBL888132 0.84 SLC29A1 (0.49) POLBSLC29A1STING1
SCHEMBL29763178 0.84 SLC29A1 (0.49) POLBSLC29A1STING1
SCHEMBL14665960 0.84 SLC29A1 (0.49) POLBSLC29A1STING1
SCHEMBL888135 0.84 SLC29A1 (0.49) POLBSLC29A1STING1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030235849-A1 Unimolecular segment amplification and sequencing LIZARDI PAUL M (MX) 2003-12-25 US disclosed
US-6632609-B2 Amplification of preferential nucleotide sequences; obtain nucleotide sequences, incubate with primers, amplify, recover replication products YALE UNIVERSITY 2003-10-14 US disclosed
US-20020192649-A1 Unimolecular segment amplifiction and sequencing YALE UNIVERSITY 2002-12-19 US disclosed
US-6329150-B1 AMPLIFYING TARGET CIRCLES BY ROLLING CIRCLE REPLICATION OF CIRCULAR NUCLEIC ACIDS; DETECT AMPLIFIED SEQUENCES USING COMBINATORIAL MULTICOLOR CODING PROBES FOR QUANTITATIVE DETECTION OF MULTIPLE DIFFERENT AMPLIFIED TARGET CIRCLES YALE UNIVERSITY 2001-12-11 US disclosed
US-6316229-B1 FOR DETECTING SINGLE NUCLEIC ACID MOLECULES USING ROLLING CIRCLE AMPLIFICATION OF SINGLE-STRANDED CIRCULAR TEMPLATES, REFERRED TO AS AMPLIFICATION TARGET CIRCLES, PRIMED BY IMMOBILIZED PRIMERS YALE UNIVERSITY 2001-11-13 US disclosed
EP-0862656-B1 UNIMOLECULAR SEGMENT AMPLIFICATION AND DETECTION UNIV YALE (US) 2001-03-07 EP disclosed
US-6143495-A DETECTING SPECIFIC NUCLEIC ACIDS OR ANALYTES IN SAMPLE WITH HIGH SPECIFICITY AND SENSITIVITY YALE UNIVERSITY (US) 2000-11-07 US disclosed