SCHEMBL22399501

SCHEMBL22399501

CNc1ncnc2c1ncn2NN

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 2/20 0.62
AHCY P23526 3/20 0.45
ADORA3 P0DMS8 9/20 0.45
ADORA1 P30542 6/20 0.45
PDE4A P27815 2/20 0.45
PDE4B Q07343 2/20 0.45
PDE4C Q08493 2/20 0.45
PDE4D Q08499 2/20 0.45
PDE5A O76074 1/20 0.45
PDE1A P54750 1/20 0.45
PDE1B Q01064 1/20 0.45
PDE3B Q13370 1/20 0.45
PDE1C Q14123 1/20 0.45
PDE3A Q14432 1/20 0.45
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
P2RY1 P47900 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
SCHEMBL8970970 0.86 YTHDC1 (0.66) YTHDC1AHCYADORA3ADORA1PDE4A
SCHEMBL23771392 0.79 YTHDC1 (0.66) YTHDC1AHCYADORA3ADORA1PDE4A
SCHEMBL763699 0.77 YTHDC1 (1.00) YTHDC1ADORA3ADORA1PDE4APDE4B
SCHEMBL22399264 0.77 ADORA2A (0.56) AHCYADORA3ADORA1ADORA2AADORA2B
SCHEMBL18521272 0.75 ADORA2A (0.34) YTHDC1AHCYADORA1ADORA2AADORA2B
SCHEMBL21127807 0.75 ADORA2A (0.34) YTHDC1AHCYADORA1ADORA2AADORA2B
SCHEMBL22326706 0.75 FDPS (0.41) YTHDC1ADORA1ADORA2A
SCHEMBL20041716 0.75 YTHDC1 (0.66) YTHDC1AHCYADORA3ADORA1PDE4A
SCHEMBL28252117 0.75 YTHDC1 (0.66) YTHDC1AHCYADORA3ADORA1PDE4A
SCHEMBL28251676 0.75 YTHDC1 (0.66) YTHDC1AHCYADORA3ADORA1PDE4A

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-10766919-B2 Cyclic di-nucleotide compounds as sting agonists MERCK SHARP & DOHME CORP. (US) 2020-09-08 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 (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-10766919-B2 Cyclic di-nucleotide compounds as sting agonists STING1, CGAS, IFNAR1 YTHDC1 985/4885AHCY 4788/4885ADORA3 110/4885

“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.