SCHEMBL24239233

SCHEMBL24239233

Nc1nc2c(ncn2[C@@H]2O[C@@H]3C(O)C3[C@H]2OP(=O)(S)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](F)[C@H]2O)c(=O)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 2/20 0.56
▸ STING1 Q86WV6 9/20 0.50
▸ RNASEL Q05823 1/20 0.49

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
SCHEMBL24239238 0.94 NT5E (0.59) NT5ERNASEL
SCHEMBL18520910 0.93 ADORA1 (0.58) NT5ERNASEL
SCHEMBL18521232 0.93 ADORA1 (0.58) NT5ERNASEL
SCHEMBL18521240 0.93 ADORA1 (0.58) NT5ERNASEL
SCHEMBL18521638 0.93 ADORA1 (0.58) NT5ERNASEL
SCHEMBL18510965 0.93 ADORA1 (0.58) NT5ERNASEL
SCHEMBL18521239 0.93 ADORA1 (0.58) NT5ERNASEL
SCHEMBL18521472 0.93 ADORA1 (0.58) NT5ERNASEL
SCHEMBL21539347 0.93 ADORA1 (0.58) NT5ERNASEL
SCHEMBL18520953 0.93 ADORA1 (0.58) NT5ERNASEL

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-20220033435-A1 Cyclic Di-Nucleotide Compounds as STING Agonists MERCK SHARP & DOHME CORP. (US) 2022-02-03 — — 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 (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-20220033435-A1 Cyclic Di-Nucleotide Compounds as STING Agonists STING1, CGAS, IFNAR1 NT5E 1230/4885STING1 1/4885RNASEL 515/4885

“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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