SCHEMBL21184238

SCHEMBL21184238

COP(=O)(OC)OP(=O)(OC)OP(=O)(OC)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)[C@H](O)[C@@H]1O

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.71
▸ TGM2 P21980 1/20 0.69
▸ HINT1 P49773 3/20 0.64
▸ FUT5 Q11128 1/20 0.64
▸ IMPDH2 P12268 4/20 0.63
▸ IMPDH1 P20839 1/20 0.63
▸ KRAS P01116 7/20 0.62
▸ TAS1R3 Q7RTX0 1/20 0.58
▸ TAS1R1 Q7RTX1 1/20 0.58
▸ GSK3A P49840 2/20 0.58
▸ RPS6KA3 P51812 2/20 0.58
▸ MAPK14 Q16539 2/20 0.58

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
SCHEMBL21413213 0.95 NT5E (0.70) NT5ETGM2HINT1FUT5IMPDH2
SCHEMBL28443133 0.95 NT5E (0.76) NT5ETGM2HINT1FUT5IMPDH2
SCHEMBL22001500 0.93 NT5E (0.67) NT5ETGM2HINT1FUT5IMPDH2
SCHEMBL21184239 0.93 NT5E (0.66) NT5ETGM2HINT1FUT5IMPDH2
SCHEMBL21184270 0.93 NT5E (0.66) NT5ETGM2HINT1FUT5IMPDH2
SCHEMBL18648315 0.93 NT5E (0.71) NT5ETGM2HINT1FUT5IMPDH2
SCHEMBL21184237 0.93 NT5E (0.61) NT5ETGM2HINT1FUT5IMPDH2
SCHEMBL20850061 0.93 NT5E (0.71) NT5ETGM2HINT1FUT5IMPDH2
SCHEMBL15747222 0.93 NT5E (0.71) NT5ETGM2HINT1FUT5IMPDH2
SCHEMBL28165608 0.93 NT5E (0.71) NT5ETGM2HINT1FUT5IMPDH2

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-20190225644-A1 MRNA CAP ANALOGS AND METHODS OF MRNA CAPPING MODERNATX, INC. 2019-07-25 — — 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-20190225644-A1 MRNA CAP ANALOGS AND METHODS OF MRNA CAPPING RNGTT, RNMT, NSUN2 NT5E 572/4885TGM2 3563/4885HINT1 629/4885

“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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