SCHEMBL7792892

SCHEMBL7792892

CS(=O)(=O)c1cc(C(=O)N=C(N)N)ccc1C1C=CCC1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 5/20 0.60
SLC9A2 Q9UBY0 1/20 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
SCHEMBL27394447 0.86 SLC9A1 (0.43) SLC9A1SLC9A2
SCHEMBL7793133 0.83 SLC9A1 (0.61) SLC9A1
SCHEMBL8667613 0.82 SLC9A1 (0.38) SLC9A1SLC9A2
Hydrochloric Acid SCHEMBL8896894 0.82 SLC9A1 (0.77) SLC9A1SLC9A2
Hydrochloric Acid SCHEMBL8896327 0.80 SLC9A1 (0.73) SLC9A1SLC9A2
SCHEMBL7803068 0.79 SLC9A1 (0.48) SLC9A1
Hydrochloric Acid SCHEMBL8899664 0.79 SLC9A1 (0.72) SLC9A1SLC9A2
SCHEMBL7798473 0.76 SLC9A1 (0.59) SLC9A1
SCHEMBL8816511 0.73 SLC9A1 (0.68) SLC9A1SLC9A2
SCHEMBL9194596 0.73 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