SCHEMBL25812128

SCHEMBL25812128

Nc1ncnc2c1ncn2[C@@H]1S[C@@H]2C(OP(=O)(S)OC3[C@H](n4ccc(=O)n5ccnc45)O[C@H](CO)[C@H]3O)[C@]2(O)[C@H]1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 2/20 0.51
▸ RNASEL Q05823 5/20 0.43
▸ EGFR P00533 1/20 0.41
▸ ERBB2 P04626 1/20 0.41
▸ DPP4 P27487 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ SLC28A1 O00337 1/20 0.41
▸ MAP3K7 O43318 1/20 0.41
▸ SLC28A2 O43868 1/20 0.41
▸ GAPDH P04406 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ ADORA2A P29274 1/20 0.41
▸ ADORA2B P29275 1/20 0.41
▸ STAT6 P42226 1/20 0.41
▸ PI4KA P42356 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ PI4K2B Q8TCG2 1/20 0.41
▸ DOT1L Q8TEK3 1/20 0.41

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
SCHEMBL25815452 0.88 ADORA1 (0.55) ADORA1RNASELEGFRERBB2DPP4
SCHEMBL23619467 0.85 ADORA1 (0.53) ADORA1RNASEL
SCHEMBL25815530 0.85 ADORA1 (0.53) ADORA1RNASEL
SCHEMBL23619228 0.85 ADORA1 (0.53) ADORA1RNASEL
SCHEMBL24239194 0.83 RNASEL (0.58) ADORA1RNASELSMN1; SMN2
SCHEMBL23619502 0.83 RNASEL (0.58) ADORA1RNASELSMN1; SMN2
SCHEMBL25815460 0.81 ADORA1 (0.56) ADORA1RNASEL
SCHEMBL23619351 0.81 ADORA1 (0.56) ADORA1RNASEL
SCHEMBL25815484 0.81 ADORA1 (0.52) ADORA1RNASELEGFRERBB2
SCHEMBL23619236 0.79 ADORA1 (0.51) ADORA1RNASEL

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-11685761-B2 Cyclic di-nucleotide compounds as sting agonists MERCK SHARP & DOHME LLC (US) 2023-06-27 — — 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-11685761-B2 Cyclic di-nucleotide compounds as sting agonists STING1, CGAS, IFNAR1 ADORA1 33/4885RNASEL 591/4885EGFR 4227/4885

“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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