SCHEMBL1740952

SCHEMBL1740952

Nc1nc(=O)n([C@H]2C=C[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)cc1F

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLG P54098 2/20 0.64
P2RY2 P41231 13/20 0.41
P2RY4 P51582 8/20 0.40
ALB P02768 1/20 0.39
P2RY6 Q15077 7/20 0.39
P2RX1 P51575 2/20 0.38
P2RX3 P56373 2/20 0.38
P2RX2 Q9UBL9 1/20 0.38
ENPP1 P22413 1/20 0.38
P2RY1 P47900 1/20 0.38
P2RY11 Q96G91 1/20 0.38
P2RX4 Q99571 1/20 0.38

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
SCHEMBL9856521 0.88 POLG (0.50) POLGP2RY2P2RY4P2RY6P2RX1
SCHEMBL9856523 0.82 POLG (0.63) POLGP2RY2P2RY4P2RY6
SCHEMBL599700 0.80 POLG (0.66) POLGP2RY2P2RY4ALBP2RY6
SCHEMBL599699 0.80 POLG (0.66) POLGP2RY2P2RY4ALBP2RY6
SCHEMBL18852597 0.80 POLG (0.63) POLGP2RY2P2RY4P2RY6P2RX1
SCHEMBL16805404 0.80 POLG (0.63) POLGP2RY2P2RY4P2RY6P2RX1
SCHEMBL18858934 0.80 POLG (0.63) POLGP2RY2P2RY4P2RY6P2RX1
SCHEMBL13199313 0.80 POLG (0.71) POLGP2RY2P2RY4ALBP2RY6
SCHEMBL18870814 0.80 POLG (0.63) POLGP2RY2P2RY4P2RY6P2RX1
SCHEMBL6909903 0.80 POLG (0.71) POLGP2RY2P2RY4ALBP2RY6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9861652-B2 2′ Fluoronucleosides EMORY UNIVERSITY (US) 2018-01-09 US disclosed
US-20160158266-A1 2' FLUORONUCLEOSIDES EMORY UNIVERSITY 2016-06-09 US disclosed
US-9180138-B2 2′-fluoronucleosides UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2015-11-10 US disclosed
US-20130157971-A1 2'-FLUORONUCLEOSIDES SCHINAZI RAYMOND F (US) 2013-06-20 US disclosed
US-8168583-B2 2-fluoronucleosides UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2012-05-01 US disclosed
EP-2392580-A1 2'-fluoronucleosides Emory University (US) 2011-12-07 EP disclosed
EP-2390257-A1 2'-fluoronucleosides Emory University (US) 2011-11-30 EP disclosed
US-20110256952-A1 GOLF CLUB, SHAFT REPLACING METHOD AND HEAD REPLACING METHOD BRIDGESTONE SPORTS CO., LTD. (JP) 2011-10-20 US disclosed
US-20100173863-A1 2-Fluoronucleosides NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-07-08 US disclosed
US-7662938-B2 2′-fluoronucleosides EMORY UNIVERSITY (US) 2010-02-16 US disclosed
US-20080300398-A1 2'-FLUORONUCLEOSIDES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-12-04 US disclosed
US-7307065-B2 2′-Fluoronucleosides EMORY UNIVERSITY (US) 2007-12-11 US disclosed
EP-1754710-A2 2'-Fluoroncucleosides Emory University (US) 2007-02-21 EP disclosed
US-6911424-B2 2′-fluoronucleosides EMORY UNIVERSITY (US) 2005-06-28 US disclosed
US-20040254141-A1 2'-Fluoronucleosides NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-12-16 US disclosed
US-20020198171-A1 2'-fluoronucleosides NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-12-26 US disclosed
US-6348587-B1 PURINE OR PYRIMIDINE BASE DERIVATIVES; ANTICANCER, ANTITUMOR AND ANTIPROLIFERATIVE AGENTS; TREATING HIV AND HEPATITIS EMORY UNIVERSITY 2002-02-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020198171-A1 2'-fluoronucleosides NSUN2, PNP, FDPS POLG 2013/4885P2RY2 1102/4885P2RY4 1421/4885
US-20040254141-A1 2'-Fluoronucleosides NSUN2, PNP, FDPS POLG 2013/4885P2RY2 1102/4885P2RY4 1421/4885
US-20100173863-A1 2-Fluoronucleosides PNP, BCL3, NPC1 POLG 1938/4885P2RY2 1197/4885P2RY4 1631/4885
US-20080300398-A1 2'-FLUORONUCLEOSIDES METTL3, BCL3, PNP POLG 3270/4885P2RY2 705/4885P2RY4 733/4885
US-20160158266-A1 2' FLUORONUCLEOSIDES PNP, BCL3, NPC1 POLG 2001/4885P2RY2 1271/4885P2RY4 1615/4885
US-20130157971-A1 2'-FLUORONUCLEOSIDES PNP, BCL3, FUBP3 POLG 1914/4885P2RY2 1271/4885P2RY4 1623/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.