SCHEMBL7797751

SCHEMBL7797751

Cc1cc(C(F)(F)F)c(S(C)(=O)=O)cc1C(=O)N=C(N)N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.72

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
SCHEMBL6935465 0.95 SLC9A1 (0.72) SLC9A1
SCHEMBL9018727 0.90 SLC9A1 (0.68) SLC9A1
SCHEMBL8531034 0.89 SLC9A1 (0.76) SLC9A1
SCHEMBL8612833 0.86 SLC9A1 (0.64) SLC9A1
Rimeporide SCHEMBL1019633 0.84 SLC9A1 (1.00) SLC9A1
Rimeporide SCHEMBL30309010 0.84 SLC9A1 (1.00) SLC9A1
SCHEMBL6930558 0.83 SLC9A1 (0.59) SLC9A1
SCHEMBL8531009 0.83 SLC9A1 (0.85) SLC9A1
Rimeporide SCHEMBL16712399 0.83 SLC9A1 (0.97) SLC9A1
Rimeporide SCHEMBL1022632 0.83 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1131064-A2 USE OF BENZOYLGUANIDINES FOR THE TREATMENT OF NON-INSULIN-DEPENDENT DIABETES MELLITUS MERCK PATENT GmbH (DE) 2001-09-12 EP claimed
EP-0743301-B1 Benzoylguanidines containing fluorine MERCK PATENT GMBH (DE) 2001-08-29 EP claimed
WO-2000030624-A2 USE OF BENZOYLGUANIDINES FOR THE TREATMENT OF NON-INSULIN-DEPENDENT DIABETES MELLITUS MERCK PATENT GMBH (DE) 2000-06-02 WO claimed
US-5747539-A Fluorine-containing benzoylguanidines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-05-05 US claimed
EP-0743301-A2 Benzoylguanidines containing fluorine MERCK PATENT GmbH (DE) 1996-11-20 EP claimed
JP-8311011-A None JP disclosed
EP-1131064-A2 USE OF BENZOYLGUANIDINES FOR THE TREATMENT OF NON-INSULIN-DEPENDENT DIABETES MELLITUS MERCK PATENT GmbH (DE) 2001-09-12 EP disclosed
EP-0743301-B1 Benzoylguanidines containing fluorine MERCK PATENT GMBH (DE) 2001-08-29 EP disclosed
WO-2000030624-A2 USE OF BENZOYLGUANIDINES FOR THE TREATMENT OF NON-INSULIN-DEPENDENT DIABETES MELLITUS MERCK PATENT GMBH (DE) 2000-06-02 WO disclosed
US-5747539-A Fluorine-containing benzoylguanidines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-05-05 US disclosed
JP-H08311011-A FLUORINE-CONTAINING BENZOYGUANIDINE MERCK PATENT GMBH 1996-11-26 JP disclosed
EP-0743301-A2 Benzoylguanidines containing fluorine MERCK PATENT GmbH (DE) 1996-11-20 EP disclosed