SCHEMBL8663590

SCHEMBL8663590

C#CCc1cc(C)c(C(=O)N=C(N)N)cc1S(C)(=O)=O

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.68

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
SCHEMBL8664618 0.87 SLC9A1 (0.53) SLC9A1
SCHEMBL8529685 0.87 SLC9A1 (0.76) SLC9A1
SCHEMBL8534309 0.83 SLC9A1 (0.70) SLC9A1
SCHEMBL8529994 0.83 SLC9A1 (0.70) SLC9A1
Rimeporide SCHEMBL1019633 0.82 SLC9A1 (1.00) SLC9A1
Rimeporide SCHEMBL30309010 0.82 SLC9A1 (1.00) SLC9A1
SCHEMBL7799001 0.82 SLC9A1 (0.72) SLC9A1
SCHEMBL8529013 0.81 SLC9A1 (0.67) SLC9A1
SCHEMBL7799018 0.81 SLC9A1 (0.67) SLC9A1
SCHEMBL7802906 0.81 SLC9A1 (0.67) SLC9A1

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-5731351-A Alkenyl-benzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-03-24 US disclosed