SCHEMBL14549833

SCHEMBL14549833

COC(=O)N(C)c1c(N)nc(-n2nc(Cc3c(F)ccc(F)c3F)c3cc(-c4ccccc4)ccc32)nc1N

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GUCY1A1 Q02108 19/20 0.80
GUCY1B1 Q02153 19/20 0.80
KCNH2 Q12809 13/20 0.79
ADORA3 P0DMS8 1/20 0.39

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
SCHEMBL14481628 0.92 GUCY1A1 (0.67) GUCY1A1GUCY1B1KCNH2
SCHEMBL2450778 0.89 GUCY1A1 (0.86) GUCY1A1GUCY1B1KCNH2
SCHEMBL14549794 0.89 GUCY1A1 (1.00) GUCY1A1GUCY1B1KCNH2
SCHEMBL14549781 0.89 GUCY1A1 (1.00) GUCY1A1GUCY1B1KCNH2
SCHEMBL12323241 0.86 GUCY1A1 (0.73) GUCY1A1GUCY1B1KCNH2
SCHEMBL14481625 0.83 GUCY1A1 (0.55) GUCY1A1GUCY1B1KCNH2
SCHEMBL2509735 0.82 GUCY1A1 (0.55) GUCY1A1GUCY1B1KCNH2
SCHEMBL14482021 0.81 GUCY1A1 (0.70) GUCY1A1GUCY1B1KCNH2
SCHEMBL2447914 0.81 GUCY1A1 (0.82) GUCY1A1GUCY1B1KCNH2
SCHEMBL2520175 0.81 GUCY1A1 (0.82) GUCY1A1GUCY1B1KCNH2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284301-B2 Soluble guanylate cyclase activators MERCK SHARP & DOHME CORP. (US) 2016-03-15 US disclosed
US-20130012511-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME LLC 2013-01-10 US disclosed
US-20130012511-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME LLC 2013-01-10 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-20130012511-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS PDE3B, PDE3A, GUCY1B1 GUCY1A1 5/4885GUCY1B1 3/4885KCNH2 666/4885

“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.