SCHEMBL17517366

SCHEMBL17517366

[2H]c1nc(NC([2H])([2H])c2c([2H])c(C)c([2H])c([2H])c2F)c(C(=N)c2nc(N)c(N(C(=O)OC)C([2H])([2H])[2H])c(N)n2)c([2H])c1[2H]

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GUCY1A1 Q02108 1/20 0.30
GUCY1B1 Q02153 1/20 0.30

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
SCHEMBL17517356 0.95 GUCY1A1 (0.34) GUCY1A1GUCY1B1
SCHEMBL17517363 0.93 GUCY1A1 (0.30) GUCY1A1GUCY1B1
SCHEMBL17517355 0.88 GUCY1A1 (0.34) GUCY1A1GUCY1B1
SCHEMBL17517360 0.88 GUCY1A1 (0.39) GUCY1A1GUCY1B1
SCHEMBL17517354 0.88
SCHEMBL17517357 0.83 GUCY1A1 (0.43) GUCY1A1GUCY1B1
SCHEMBL17517367 0.82 KCNH2 (0.41) GUCY1A1GUCY1B1
SCHEMBL17517365 0.77 KCNH2 (0.40) GUCY1A1GUCY1B1
SCHEMBL12364302 0.73 KCNH2 (0.49) GUCY1A1GUCY1B1
SCHEMBL12364301 0.71 KCNH2 (0.55) GUCY1A1GUCY1B1

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-20160122347-A1 4,6-DIAMINOPYRIMIDINE STIMULATORS OF SOLUBLE GUANYLATE CYCLASE AUSPEX PHARMACEUTICALS INC (US) 2016-05-05 US disclosed
US-9260424-B2 4,6-diaminopyrimidine stimulators of soluble guanylate cyclase AUSPEX PHARMACEUTICALS, INC. (US) 2016-02-16 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-20160122347-A1 4,6-DIAMINOPYRIMIDINE STIMULATORS OF SOLUBLE GUANYLATE CYCLASE GUCY1B2, GUCY1A2, GUCY1A1 GUCY1A1 3/4885GUCY1B1 7/4885

“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.