SCHEMBL16499028

SCHEMBL16499028

Nc1nc(N)c(C(=O)NC(=NC(=O)O)NCCCCc2ccc(OCC(O)CO)cc2)nc1Cl

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SCNN1A P37088 20/20 0.70

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
SCHEMBL16499025 1.00 SCNN1A (0.70) SCNN1A
552-02 Free Base SCHEMBL9913757 0.87 SCNN1A (0.71) SCNN1A
552-02 Free Base SCHEMBL2015162 0.87 SCNN1A (0.71) SCNN1A
552-02 Free Base SCHEMBL9913774 0.87 SCNN1A (0.71) SCNN1A
552-02 Free Base SCHEMBL19348088 0.87 SCNN1A (0.70) SCNN1A
SCHEMBL916347 0.85 SCNN1A (0.67) SCNN1A
552-02 Free Base SCHEMBL29615808 0.85 SCNN1A (0.67) SCNN1A
552-02 Free Base SCHEMBL15092803 0.85 SCNN1A (0.67) SCNN1A
552-02 Free Base SCHEMBL14892867 0.84 SCNN1A (0.68) SCNN1A
552-02 Free Base SCHEMBL14892868 0.84 SCNN1A (0.68) SCNN1A

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
WO-2011156355-A1 PRODUCTION METHOD OF PHENYL GUANIDINE SALTS AND THEIR INTERMEDIATES KAINOS MEDICINE, INC. (KR) 2011-12-15 WO disclosed