SCHEMBL6934853

SCHEMBL6934853

CCc1cc(S(=O)(=O)c2ccc(Br)cc2)c(C(F)(F)F)cc1C(=O)N=C(N)N

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.39
SLC9A1 P19634 1/20 0.37

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
SCHEMBL7073340 0.90 HSD11B1 (0.40) SLC9A1
SCHEMBL6936925 0.90 SLC9A1 (0.42) SLC9A1
SCHEMBL6932213 0.89 FLT1 (0.39)
SCHEMBL6936937 0.89 SLC9A1 (0.40) SLC9A1
SCHEMBL6934520 0.87 SLC9A1 (0.50) SLC9A1
SCHEMBL6938037 0.84 SLC9A1 (0.39) SLC9A1
SCHEMBL6933420 0.84 SLC9A1 (0.51) SLC9A1
SCHEMBL6936878 0.83 SLC9A1 (0.41) SLC9A1
SCHEMBL6932226 0.83 SLC9A1 (0.40) SLC9A1
SCHEMBL6932510 0.83 SLC9A1 (0.43) 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-0758644-B1 Sulfonyl- or sulfinyl-benzoyl-guanidine derivatives MERCK PATENT GMBH (DE) 2003-10-15 EP disclosed
US-5744641-A Sulfonyl- or sulfinylbenzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-04-28 US disclosed
EP-0758644-A1 Sulfonyl- or sulfinyl-benzoyl-guanidine derivatives MERCK PATENT GmbH (DE) 1997-02-19 EP disclosed