SCHEMBL21418544

SCHEMBL21418544

O=P(O)(O)OP(=O)(O)OP(=O)(O)O[C@@H]1C[C@H](F)[C@H](n2cc(F)c(=S)[nH]c2=S)O1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 7/20 0.35
▸ P2RY4 P51582 3/20 0.35
▸ POLG P54098 1/20 0.35
▸ POLB P06746 1/20 0.30
▸ POLA1 P09884 1/20 0.30
▸ POLD1 P28340 1/20 0.30
▸ P2RY14 Q15391 1/20 0.30
▸ P2RY6 Q15077 2/20 0.30

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
SCHEMBL21418540 0.91 P2RY2 (0.39) P2RY2P2RY4POLGPOLBPOLA1
SCHEMBL21418538 0.91 P2RY2 (0.36) P2RY2P2RY4POLGPOLBPOLA1
SCHEMBL16575905 0.83 P2RY2 (0.43) P2RY2P2RY4POLGPOLBPOLA1
SCHEMBL17976659 0.83 P2RY2 (0.43) P2RY2P2RY4POLGPOLBPOLA1
SCHEMBL17971852 0.83 P2RY2 (0.43) P2RY2P2RY4POLGPOLBPOLA1
SCHEMBL21418546 0.83 P2RY2 (0.44) P2RY2P2RY4POLA1P2RY14P2RY6
SCHEMBL21418545 0.82 P2RY2 (0.54) P2RY2P2RY4POLA1P2RY14P2RY6
SCHEMBL21418659 0.82 POLG (0.47) P2RY2P2RY4POLGP2RY6
SCHEMBL21418537 0.78 P2RY2 (0.52) P2RY2P2RY4P2RY14P2RY6
SCHEMBL21418393 0.78 POLG (0.34) P2RY2P2RY4POLGPOLA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11166973-B2 Substituted nucleotides and nucleosides for treating viral infections EMORY UNIVERSITY (US) 2021-11-09 — — US disclosed
US-20190298750-A1 Nucleotide and Nucleoside Therapeutic Compositions and Uses Related Thereto DEFENSE THREAT REDUCTION AGENCY, US DOD 2019-10-03 — — 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-11166973-B2 Substituted nucleotides and nucleosides for treating viral infections PNP, TYMP, HPRT1 P2RY2 316/4885P2RY4 230/4885POLG 601/4885
US-20190298750-A1 Nucleotide and Nucleoside Therapeutic Compositions and Uses Related Thereto PNP, NTPCR, TYMP P2RY2 452/4885P2RY4 288/4885POLG 448/4885

“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.

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