SCHEMBL8533979

SCHEMBL8533979

CCCCCc1cc(C)c(C(=O)N=C(N)N)cc1S(C)(=O)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.65

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
SCHEMBL8532851 0.99 SLC9A1 (0.64) SLC9A1
SCHEMBL8529013 0.96 SLC9A1 (0.67) SLC9A1
SCHEMBL8534309 0.91 SLC9A1 (0.70) SLC9A1
SCHEMBL8529129 0.89 SLC9A1 (0.52) SLC9A1
SCHEMBL8533757 0.88 SLC9A1 (0.51) SLC9A1
SCHEMBL8528309 0.88 SLC9A1 (0.51) SLC9A1
SCHEMBL8529685 0.87 SLC9A1 (0.76) SLC9A1
SCHEMBL8530560 0.87 SLC9A1 (0.50) SLC9A1
SCHEMBL8533227 0.87 SLC9A1 (0.50) SLC9A1
SCHEMBL8578791 0.87 SLC9A1 (0.50) 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 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