SCHEMBL18574261

SCHEMBL18574261

Cn1c(=O)ccn([C@@H]2O[C@H](COP(=O)(Cl)Cl)C(O)C2O)c1=O

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ UMPS P11172 1/20 0.53
▸ NT5E P21589 2/20 0.52
▸ P2RY6 Q15077 8/20 0.52
▸ P2RY2 P41231 9/20 0.51
▸ P2RY4 P51582 4/20 0.51
▸ P2RY14 Q15391 1/20 0.50

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
SCHEMBL14946368 1.00 UMPS (0.53) UMPSNT5EP2RY6P2RY2P2RY4
SCHEMBL14929324 1.00 UMPS (0.53) UMPSNT5EP2RY6P2RY2P2RY4
SCHEMBL31685569 0.90 UMPS (0.66) UMPSNT5EP2RY6P2RY2P2RY4
SCHEMBL15810653 0.89 UMPS (0.62) UMPSNT5EP2RY6P2RY2P2RY4
SCHEMBL18852571 0.89 UMPS (0.62) UMPSNT5EP2RY6P2RY2P2RY4
SCHEMBL17211014 0.89 UMPS (0.62) UMPSNT5EP2RY6P2RY2P2RY4
SCHEMBL21742443 0.86 P2RY6 (0.69) NT5EP2RY6P2RY14
SCHEMBL29185234 0.84 NT5E (0.67) NT5EP2RY6P2RY2P2RY4
SCHEMBL14946397 0.84 NT5E (0.67) NT5EP2RY6P2RY2P2RY4
SCHEMBL18574264 0.84 NT5E (0.67) NT5EP2RY6P2RY2P2RY4

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-20210308283-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNA THERAPEUTICS, INC. 2021-10-07 — — US disclosed
US-20170056528-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNATX, INC. 2017-03-02 — — 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-20210308283-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, NSUN2 UMPS 36/4885NT5E 10/4885P2RY6 339/4885
US-20170056528-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, NSUN2 UMPS 36/4885NT5E 10/4885P2RY6 339/4885

“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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