E626

E626

SCHEMBL22134207

N.N.N.Nc1nc2c(ncn2[C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1.[N-]=[N+]=NCCNP(=O)(O)O

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.65
▸ NT5E P21589 1/20 0.65
▸ IMPDH2 P12268 6/20 0.60
▸ IMPDH1 P20839 2/20 0.60
▸ TAS1R3 Q7RTX0 1/20 0.60
▸ TAS1R1 Q7RTX1 1/20 0.60
▸ KRAS P01116 11/20 0.59

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
SCHEMBL21742682 0.92 NT5E (0.69) TGM2NT5EIMPDH2IMPDH1TAS1R3
Ammonia Solution, Strong SCHEMBL22134206 0.91 TGM2 (0.63) TGM2NT5EIMPDH2IMPDH1TAS1R3
SCHEMBL21742687 0.89 TGM2 (0.75) TGM2NT5EKRAS
E626 SCHEMBL11777031 0.88 NT5E (0.81) TGM2NT5EIMPDH2IMPDH1TAS1R3
E626 SCHEMBL21163348 0.87 NT5E (0.83) TGM2NT5EIMPDH2IMPDH1TAS1R3
E626 SCHEMBL5854 0.87 NT5E (0.83) TGM2NT5EIMPDH2IMPDH1TAS1R3
E626 SCHEMBL20677331 0.87 NT5E (0.83) TGM2NT5EIMPDH2IMPDH1TAS1R3
E626 SCHEMBL20277596 0.87 NT5E (0.83) TGM2NT5EIMPDH2IMPDH1TAS1R3
E626 SCHEMBL21803790 0.87 NT5E (0.83) TGM2NT5EIMPDH2IMPDH1TAS1R3
E626 SCHEMBL18785103 0.87 NT5E (0.83) TGM2NT5EIMPDH2IMPDH1TAS1R3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10696709-B2 Phosphotriazole MRNA 5′-end cap analogs, composition comprising the same, RNA molecule incorporating the same, uses thereof and method of synthesizing RNA molecule, protein or peptide UNIWERSYTET WARSZAWSKI (PL) 2020-06-30 — — 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 (1 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-10696709-B2 Phosphotriazole MRNA 5′-end cap analogs, composition comprising the same, RNA molecule incorporating the same, uses thereof and method of synthesizing RNA molecule, protein or peptide RNGTT, RNMT, NSUN3 TGM2 3265/4885NT5E 1027/4885IMPDH2 1459/4885

“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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