SCHEMBL23619260

SCHEMBL23619260

CNc1nnc2c(=O)[nH]ccn12

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.42
BRD4 O60885 1/20 0.36

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
SCHEMBL24236941 0.83 ADORA3 (0.42) ADORA3BRD4
SCHEMBL18519546 0.77 ADORA3 (0.44) ADORA3BRD4
SCHEMBL21137626 0.72 ADORA3 (0.42) ADORA3BRD4
SCHEMBL23476796 0.72 ADORA3 (0.42) ADORA3BRD4
SCHEMBL18510357 0.72 ADORA3 (0.42) ADORA3BRD4
SCHEMBL21137236 0.70 ADORA3 (0.40) ADORA3BRD4
SCHEMBL17674862 0.70 GRIN2D (0.41) ADORA3BRD4
SCHEMBL21539430 0.69 ADORA3 (0.42) ADORA3BRD4
SCHEMBL22326718 0.68 ADORA3 (0.39) ADORA3BRD4
SCHEMBL24859515 0.64 BRD4 (0.41) ADORA3BRD4

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-11685761-B2 Cyclic di-nucleotide compounds as sting agonists MERCK SHARP & DOHME LLC (US) 2023-06-27 US disclosed
US-20210206796-A1 CYCLIC DI-NUCLEOTIDE COMPOUNDS AS STING AGONISTS MERCK SHARP & DOHME CORP. (US) 2021-07-08 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-20210206796-A1 CYCLIC DI-NUCLEOTIDE COMPOUNDS AS STING AGONISTS STING1, CGAS, IFNAR1 ADORA3 122/4885BRD4 1650/4885
US-11685761-B2 Cyclic di-nucleotide compounds as sting agonists STING1, CGAS, IFNAR1 ADORA3 117/4885BRD4 1619/4885

“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.