SCHEMBL7797840

SCHEMBL7797840

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

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.67

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
SCHEMBL8612265 0.95 SLC9A1 (0.61) SLC9A1
SCHEMBL8442619 0.90 SLC9A1 (0.70) SLC9A1
SCHEMBL8438219 0.84 SLC9A1 (0.74) SLC9A1
SCHEMBL9018724 0.82 SLC9A1 (0.67) SLC9A1
SCHEMBL9018688 0.82 SLC9A1 (0.67) SLC9A1
SCHEMBL8438810 0.82 SLC9A1 (0.70) SLC9A1
SCHEMBL7797862 0.81 EGLN1 (0.43) SLC9A1
SCHEMBL9018675 0.81 SLC9A1 (0.57) SLC9A1
SCHEMBL8439131 0.81 SLC9A1 (0.68) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0743301-B1 Benzoylguanidines containing fluorine MERCK PATENT GMBH (DE) 2001-08-29 EP claimed
EP-0743301-B1 Benzoylguanidines containing fluorine MERCK PATENT GMBH (DE) 2001-08-29 EP disclosed
EP-0743301-A2 Benzoylguanidines containing fluorine MERCK PATENT GmbH (DE) 1996-11-20 EP disclosed