SCHEMBL8538604

SCHEMBL8538604

CCCCS(=O)(=O)c1cc(C)c(C(=O)N=C(N)N)cc1S(C)(=O)=O

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.73

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
SCHEMBL6935450 0.96 SLC9A1 (0.71) SLC9A1
SCHEMBL6930618 0.95 SLC9A1 (0.70) SLC9A1
SCHEMBL6937555 0.93 SLC9A1 (0.77) SLC9A1
SCHEMBL6935053 0.89 SLC9A1 (0.83) SLC9A1
SCHEMBL6932343 0.88 SLC9A1 (0.54) SLC9A1
Rimeporide SCHEMBL1019633 0.85 SLC9A1 (1.00) SLC9A1
Rimeporide SCHEMBL30309010 0.85 SLC9A1 (1.00) SLC9A1
SCHEMBL6937007 0.84 SLC9A1 (0.53) SLC9A1
Rimeporide SCHEMBL16712399 0.84 SLC9A1 (0.97) SLC9A1
Rimeporide SCHEMBL1022632 0.84 SLC9A1 (0.97) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5744641-A Sulfonyl- or sulfinylbenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-04-28 US disclosed
EP-0758644-A1 Sulfonyl- or sulfinyl-benzoyl-guanidine derivatives MERCK PATENT GmbH (DE) 1997-02-19 EP disclosed