SCHEMBL25819849

SCHEMBL25819849

CC(N)n1cc(C(N)=O)cn1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 13/20 0.49
LMNA P02545 1/20 0.38
MKNK1 Q9BUB5 2/20 0.38
MKNK2 Q9HBH9 2/20 0.38
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
MAPKAPK2 P49137 1/20 0.35
MAP4K4 O95819 1/20 0.35
PARP10 Q53GL7 1/20 0.34

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
SCHEMBL659349 0.87 ACHE (0.64) ACHELMNAMKNK1MKNK2ADORA2A
SCHEMBL28309802 0.85 ACHE (0.49) ACHELMNAMKNK1MKNK2ADORA2A
SCHEMBL12862846 0.84 ACHE (0.47) ACHELMNAMKNK1MKNK2ADORA2A
SCHEMBL22399206 0.81 ACHE (0.68) ACHELMNAMKNK1MKNK2
SCHEMBL30961721 0.81 ACHE (0.51) ACHELMNAMKNK1MKNK2
SCHEMBL30686643 0.80 ACHE (0.54) ACHELMNAMKNK1MKNK2ADORA2A
SCHEMBL29175561 0.80 ACHE (0.54) ACHELMNAMKNK1MKNK2ADORA2A
SCHEMBL31612737 0.80 ACHE (0.44) ACHELMNAMKNK1MKNK2ADORA2A
SCHEMBL566139 0.79 ACHE (0.50) ACHELMNAMKNK1MKNK2MAP4K4
SCHEMBL6238381 0.79 ACHE (0.67) ACHELMNAMKNK1MKNK2MAPKAPK2

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 ACHE 4607/4885LMNA 1653/4885MKNK1 3975/4885

“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.