SCHEMBL24503585

SCHEMBL24503585

COC(=O)C(C)c1c(N)nc(-c2nn(Cc3ccccc3F)c3ncccc23)nc1N

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.73
KCNH2 Q12809 1/20 0.73
GUCY1A1 Q02108 9/20 0.54
GUCY1B1 Q02153 9/20 0.54
PDE5A O76074 9/20 0.53

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
SCHEMBL19399351 0.88 ADORA3 (0.57) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL21227075 0.86 ADORA3 (0.65) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL174771 0.86 ADORA3 (0.66) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL15015881 0.86 ADORA3 (0.66) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL27557122 0.85 ADORA3 (0.67) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
Riociguat SCHEMBL245457 0.84 KCNH2 (1.00) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
Riociguat SCHEMBL29357210 0.84 KCNH2 (1.00) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
Riociguat SCHEMBL29379983 0.84 KCNH2 (1.00) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
Riociguat SCHEMBL29419573 0.84 KCNH2 (1.00) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A
SCHEMBL29379641 0.84 ADORA3 (0.73) ADORA3KCNH2GUCY1A1GUCY1B1PDE5A

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-11357777-B2 Use of sGC stimulators for the treatment of nonalcoholic steatohepatitis (NASH) CYCLERION THERAPEUTICS, INC. (US) 2022-06-14 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-11357777-B2 Use of sGC stimulators for the treatment of nonalcoholic steatohepatitis (NASH) GLS2, GPR119, PRKG1 ADORA3 2184/4885KCNH2 4187/4885GUCY1A1 8/4885

“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.