SCHEMBL7802002

SCHEMBL7802002

CCc1cc(C(C)=C(C)C)c(S(C)(=O)=O)cc1C(=O)N=C(N)N

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.55

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
SCHEMBL7793011 0.87 SLC9A1 (0.55) SLC9A1
SCHEMBL6932523 0.86 SLC9A1 (0.68) SLC9A1
SCHEMBL7798675 0.86 SLC9A1 (0.53) SLC9A1
SCHEMBL7798676 0.86 SLC9A1 (0.53) SLC9A1
SCHEMBL8534951 0.85 SLC9A1 (0.61) SLC9A1
SCHEMBL7798802 0.84 SLC9A1 (0.74) SLC9A1
SCHEMBL7798622 0.83 SLC9A1 (0.53) SLC9A1
SCHEMBL8441408 0.82 SLC9A1 (0.58) SLC9A1
SCHEMBL8533047 0.82 SLC9A1 (0.67) SLC9A1
SCHEMBL8056079 0.81 SLC9A1 (0.57) 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-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