SCHEMBL7802801

SCHEMBL7802801

C/C=C(/C)c1ccc(C(=O)N=C(N)N)cc1S(C)(=O)=O

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 5/20 0.60
SLC9A2 Q9UBY0 1/20 0.60

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
SCHEMBL7802806 1.00 SLC9A1 (0.60) SLC9A1SLC9A2
SCHEMBL7798541 0.85 SLC9A1 (0.61) SLC9A1SLC9A2
SCHEMBL7798637 0.85 SLC9A1 (0.61) SLC9A1SLC9A2
SCHEMBL7802040 0.81 SLC9A1 (0.72) SLC9A1
SCHEMBL7802042 0.81 SLC9A1 (0.72) SLC9A1
SCHEMBL7798987 0.79 SLC9A1 (0.57) SLC9A1SLC9A2
SCHEMBL8663326 0.79 SLC9A1 (0.34) SLC9A1SLC9A2
SCHEMBL8663328 0.79 SLC9A1 (0.34) SLC9A1SLC9A2
SCHEMBL8816511 0.79 SLC9A1 (0.68) SLC9A1SLC9A2
SCHEMBL9194596 0.79 SLC9A1 (0.68) SLC9A1SLC9A2

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-0760365-B1 Alkenyl-benzoylguanidines MERCK PATENT GMBH (DE) 2001-01-03 EP disclosed
US-5731351-A Alkenyl-benzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-03-24 US disclosed
EP-0760365-A2 Alkenyl-benzoylguanidines MERCK PATENT GmbH (DE) 1997-03-05 EP disclosed