SCHEMBL8528490

SCHEMBL8528490

Cc1c(C(=O)N=C(N)N)ccc(-c2cccc(Cl)c2)c1S(C)(=O)=O

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 8/20 0.53

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
SCHEMBL8528444 0.91 SLC9A1 (0.50) SLC9A1
SCHEMBL27348223 0.86 SLC9A1 (0.40) SLC9A1
SCHEMBL8534928 0.83 DCLRE1B (0.45) SLC9A1
SCHEMBL8700142 0.81 MKNK1 (0.43) SLC9A1
SCHEMBL8532248 0.77 SLC9A1 (0.48) SLC9A1
SCHEMBL8533825 0.75 SLC9A1 (0.55) SLC9A1
SCHEMBL8699934 0.74 SLC9A1 (0.40) SLC9A1
SCHEMBL7822727 0.73 SLC9A1 (0.60) SLC9A1
SCHEMBL8534938 0.72 SLC9A1 (0.44) SLC9A1
SCHEMBL8610884 0.72 ABL1 (0.44)

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-0699660-B1 Arylbenzoylguanidines MERCK PATENT GMBH (DE) 1998-10-28 EP disclosed
US-5807896-A Arylbenzoylguanidines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTING (DE) 1998-09-15 US disclosed
EP-0699660-A2 Arylbenzoylguanidines MERCK PATENT GmbH (DE) 1996-03-06 EP disclosed