SCHEMBL7766587

SCHEMBL7766587

Cc1cc(N(C)c2ccccc2)c(S(C)(=O)=O)cc1C(=O)N=C(N)N

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.62
SLC9A3 P48764 1/20 0.55
SLC9A2 Q9UBY0 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
SCHEMBL7761328 0.89 SLC9A1 (0.64) SLC9A1
SCHEMBL7766624 0.89 SLC9A1 (0.60) SLC9A1
SCHEMBL7764817 0.89 SLC9A1 (0.60) SLC9A1
SCHEMBL7761267 0.89 SLC9A1 (0.60) SLC9A1
SCHEMBL7768676 0.88 SLC9A1 (0.56) SLC9A1SLC9A3SLC9A2
SCHEMBL7761295 0.88 SLC9A1 (0.56) SLC9A1
SCHEMBL7768678 0.87 SLC9A1 (0.55) SLC9A1SLC9A3SLC9A2
SCHEMBL7764019 0.87 SLC9A1 (0.57) SLC9A1
SCHEMBL7761373 0.86 SLC9A1 (0.47) SLC9A1
SCHEMBL8632179 0.86 SLC9A1 (0.54) 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-0723963-B1 4-amino-benzoylguanidine derivatives MERCK PATENT GMBH (DE) 2001-06-13 EP disclosed
US-5739142-A 4-aminobenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-04-14 US disclosed
EP-0723963-A1 4-amino-benzoylguanidine derivatives MERCK PATENT GmbH (DE) 1996-07-31 EP disclosed