SCHEMBL8530990

SCHEMBL8530990

Cc1cc(Br)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 0.68

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
SCHEMBL8530957 0.90 SLC9A1 (0.57) SLC9A1
SCHEMBL7800866 0.88 SLC9A1 (0.78) SLC9A1
SCHEMBL8531009 0.86 SLC9A1 (0.85) SLC9A1
SCHEMBL8530195 0.83 SLC9A1 (0.57) SLC9A1
SCHEMBL8532005 0.82 SLC9A1 (0.68) SLC9A1
SCHEMBL8532838 0.82 SLC9A1 (0.68) SLC9A1
SCHEMBL8534253 0.82 SLC9A1 (0.63) SLC9A1
SCHEMBL8532054 0.82 SLC9A1 (0.63) SLC9A1
Rimeporide SCHEMBL30309010 0.81 SLC9A1 (1.00) SLC9A1
Rimeporide SCHEMBL1019633 0.81 SLC9A1 (1.00) 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 6 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 claimed
EP-0699663-B1 Alkyl-benzoylguanidine derivatives MERCK PATENT GMBH (DE) 1998-11-04 EP claimed
EP-0699663-A1 Alkyl-benzoylguanidine derivatives MERCK PATENT GmbH (DE) 1996-03-06 EP claimed
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