SCHEMBL599700

SCHEMBL599700

Nc1nc(=O)n(C2CC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C2)cc1F

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLG P54098 3/20 0.66
ALB P02768 1/20 0.40
P2RY2 P41231 9/20 0.39
P2RY4 P51582 4/20 0.37
P2RY6 Q15077 2/20 0.37
DCK P27707 2/20 0.37
P2RX1 P51575 1/20 0.36
P2RX3 P56373 1/20 0.36
P2RX2 Q9UBL9 1/20 0.36

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
SCHEMBL599699 1.00 POLG (0.66) POLGALBP2RY2P2RY4P2RY6
SCHEMBL599687 0.89 POLG (0.51) POLGALBDCK
SCHEMBL599686 0.89 POLG (0.51) POLGALBDCK
SCHEMBL14354922 0.85 POLG (0.62) POLGALBP2RY2P2RY4P2RY6
SCHEMBL13924226 0.84 POLG (0.61) POLGALBP2RY2P2RY4P2RY6
SCHEMBL25492503 0.82 POLG (0.70) POLGP2RY2P2RY4P2RY6
SCHEMBL8409011 0.82 POLG (0.70) POLGP2RY2P2RY4P2RY6
SCHEMBL8409014 0.82 POLG (0.70) POLGP2RY2P2RY4P2RY6
SCHEMBL6714480 0.81 POLG (0.64) POLGP2RY2P2RY4P2RY6P2RX1
SCHEMBL13199313 0.81 POLG (0.71) POLGALBP2RY2P2RY4P2RY6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114994-B2 2′ and 3′-substituted cyclobutyl nucleoside analogs for the treatment viral infections and abnormal cellular proliferation EMORY UNIVERSITY (US) 2012-02-14 US disclosed
US-20090149416-A1 2' and 3'-Substituted Cyclobutyl Nucleoside Analogs for the Treatment Viral Infections and Abnormal Cellular Proliferation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-06-11 US disclosed
US-7495006-B2 2′ and 3′-substituted cyclobutyl nucleoside analogs for the treatment of viral infections and abnormal cellular proliferation EMORY UNIVERSITY (US) 2009-02-24 US disclosed
US-20060223835-A1 2' and 3'- substituted cyclobutyl nucleoside analogs for the treatment of viral infections and abnormal cellular proliferation EMORY UNIVERSITY 2006-10-05 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 (2 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-20090149416-A1 2' and 3'-Substituted Cyclobutyl Nucleoside Analogs for the Treatment Viral Infections and Abnormal Cellular Proliferation HAVCR2, PNP, PCNA POLG 930/4885ALB 2985/4885P2RY2 2433/4885
US-20060223835-A1 2' and 3'- substituted cyclobutyl nucleoside analogs for the treatment of viral infections and abnormal cellular proliferation HAVCR2, PNP, DCTD POLG 922/4885ALB 2897/4885P2RY2 2232/4885

“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.