SCHEMBL350397

SCHEMBL350397

Nc1nc2c(ncn2CCO)c(=O)[nH]1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TK1 P04183 2/20 0.82
PNP P00491 7/20 0.71
BLM P54132 2/20 0.71
USP2 O75604 1/20 0.71
TSHR P16473 1/20 0.71
EDNRA P25101 1/20 0.71
HTR2A P28223 1/20 0.71
RECQL P46063 1/20 0.71
HBB P68871 1/20 0.71
HSD17B10 Q99714 1/20 0.71
MEN1 O00255 1/20 0.68
ALDH1A1 P00352 1/20 0.68
LMNA P02545 1/20 0.68
CYP3A4 P08684 1/20 0.68
NFKB1 P19838 1/20 0.68
VCP P55072 1/20 0.68
KMT2A Q03164 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
HIF1A Q16665 1/20 0.68
HPRT1 P00492 7/20 0.67

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
SCHEMBL3836263 0.92 TK1 (0.92) TK1PNPBLMUSP2TSHR
SCHEMBL29286376 0.91 TK1 (0.76) TK1PNPBLMUSP2TSHR
SCHEMBL571645 0.90 TK1 (1.00) TK1PNPBLMUSP2TSHR
SCHEMBL8175624 0.89 TK1 (0.97) TK1PNPBLMUSP2TSHR
SCHEMBL13397350 0.88 TK1 (0.72) TK1PNPBLMUSP2TSHR
SCHEMBL2346358 0.88 PNP (0.79) TK1PNPBLMUSP2TSHR
SCHEMBL9806969 0.87 TK1 (0.71) TK1PNPBLMUSP2TSHR
Penciclovir SCHEMBL3495 0.86 TK1 (0.70) TK1PNPBLMUSP2TSHR
SCHEMBL10511427 0.85 TK1 (0.72) TK1PNPBLMUSP2TSHR
SCHEMBL667796 0.85 TK1 (0.69) TK1PNPBLMUSP2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250305030-A1 DNA ADDUCTOMICS BY MASS TAG PRELABELING UNIV NORTHEASTERN (US) 2025-10-02 US disclosed
US-12359243-B2 DNA adductomics by mass tag prelabeling NORTHEASTERN UNIVERSITY (US) 2025-07-15 US disclosed
CN-112295411-B Modified polyamide membrane and preparation method thereof 万华化学集团股份有限公司 2022-04-22 CN disclosed
EP-3350191-B9 NUCLEOTIDE ANALOGS UNIV CALIFORNIA (US) 2021-12-22 EP disclosed
US-20210340603-A1 DNA ADDUCTOMICS BY MASS TAG PRELABELING NORTHEASTERN UNIVERSITY 2021-11-04 US disclosed
EP-3350191-B1 NUCLEOTIDE ANALOGS UNIV CALIFORNIA (US) 2021-05-12 EP disclosed
CN-112295411-A Modified polyamide membrane and preparation method thereof 万华化学集团股份有限公司 2021-02-02 CN disclosed
CN-101680029-B Nucleic acid detection OXITEC LTD 2013-09-25 CN disclosed
CN-102276610-B Method for preparing N7-guanine alkylate UNIV BEIJING TECHNOLOGY 2013-01-09 CN disclosed
US-20120015874-A1 NOVEL INHIBITORS OF RETROVIRAL REVERSE TRANSCRIPTACE THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2012-01-19 US disclosed
CN-102276610-A Method for preparing N7-guanine alkylate 2011-12-14 CN disclosed
US-8030475-B2 Inhibitors of retroviral reverse transcriptase THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2011-10-04 US disclosed
CN-101680029-A Nucleic acid detection OXITEC LTD 2010-03-24 CN disclosed
US-20090305281-A1 NOVEL INHIBITORS OF RETROVIRAL REVERSE TRANSCRIPTACE THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2009-12-10 US disclosed
WO-2009143476-A2 NOVEL INHIBITORS OF RETROVIRAL REVERSE TRANSCRIPTASE THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2009-11-26 WO disclosed
US-20040161361-A1 Apparatus and method for sterilization of medical equipments, pharmaceutical products and biologically contaminated articles UHM, HAN S. 2004-08-19 US disclosed