SCHEMBL8528627

SCHEMBL8528627

CCCCc1ccc(C(=O)N=C(N)N)c(CCC)c1S(C)(=O)=O

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 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
SCHEMBL8533238 0.96 SLC9A1 (0.39) SLC9A1
SCHEMBL8529973 0.95 SLC9A1 (0.38) SLC9A1
SCHEMBL8530984 0.93 SLC9A1 (0.39) SLC9A1
SCHEMBL8530372 0.91 SLC9A1 (0.42) SLC9A1
SCHEMBL8533116 0.89 SLC9A1 (0.39) SLC9A1
SCHEMBL8529975 0.88 SLC9A1 (0.38) SLC9A1
SCHEMBL8533996 0.88 SLC9A1 (0.41) SLC9A1
SCHEMBL8581794 0.87 SLC9A1 (0.37) SLC9A1
SCHEMBL8530889 0.86 SLC9A1 (0.43) SLC9A1
SCHEMBL8530546 0.85

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-5840761-A Alkylbenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-11-24 US disclosed
EP-0699663-B1 Alkyl-benzoylguanidine derivatives MERCK PATENT GMBH (DE) 1998-11-04 EP disclosed
EP-0699663-A1 Alkyl-benzoylguanidine derivatives MERCK PATENT GmbH (DE) 1996-03-06 EP disclosed