SCHEMBL21418916

SCHEMBL21418916

CC(=O)OCC1O[C@H](n2ccc(=O)[nH]c2=O)C(C)(OC(C)=O)[C@H]1OC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 8/20 0.44
P2RY4 P51582 4/20 0.44
LMNA P02545 1/20 0.42
THRB P10828 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42
POLA1 P09884 1/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C9 P11712 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
SLC28A1 O00337 1/20 0.37
SLC28A2 O43868 1/20 0.37
SLC29A1 Q99808 1/20 0.37
SLC28A3 Q9HAS3 1/20 0.37
TSHR P16473 1/20 0.36
P2RY6 Q15077 5/20 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
SCHEMBL12805526 1.00 P2RY2 (0.44) P2RY2P2RY4LMNATHRBSMN1; SMN2
SCHEMBL21418879 1.00 P2RY2 (0.44) P2RY2P2RY4LMNATHRBSMN1; SMN2
SCHEMBL16575898 1.00 P2RY2 (0.44) P2RY2P2RY4LMNATHRBSMN1; SMN2
SCHEMBL12966484 1.00 P2RY2 (0.44) P2RY2P2RY4LMNATHRBSMN1; SMN2
SCHEMBL21418884 1.00 P2RY2 (0.44) P2RY2P2RY4LMNATHRBSMN1; SMN2
SCHEMBL21418922 0.90 P2RY2 (0.38) P2RY2P2RY4LMNATHRBSMN1; SMN2
SCHEMBL16575900 0.90 P2RY2 (0.38) P2RY2P2RY4LMNATHRBSMN1; SMN2
SCHEMBL21418880 0.90 P2RY2 (0.38) P2RY2P2RY4LMNATHRBSMN1; SMN2
SCHEMBL19534548 0.88 P2RY2 (0.52) P2RY2P2RY4LMNATHRBSMN1; SMN2
SCHEMBL19534469 0.88 P2RY2 (0.52) P2RY2P2RY4LMNATHRBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11857560-B2 Pharmaceutical compositions comprising substituted nucleotides and nucleosides for treating viral infections EMORY UNIVERSITY (US) 2024-01-02 US disclosed
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 (3 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 230/4885LMNA 2780/4885
US-11857560-B2 Pharmaceutical compositions comprising substituted nucleotides and nucleosides for treating viral infections SLC28A1, PNP, SLC28A2 P2RY2 89/4885P2RY4 66/4885LMNA 1285/4885
US-20190298750-A1 Nucleotide and Nucleoside Therapeutic Compositions and Uses Related Thereto PNP, NTPCR, TYMP P2RY2 452/4885P2RY4 288/4885LMNA 2417/4885

“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.