SCHEMBL6932226

SCHEMBL6932226

CCc1cc(S(=O)(=O)c2cccc(C)c2)c(C(F)(F)F)cc1C(=O)N=C(N)N

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 5/20 0.40
ABCC9 O60706 1/20 0.39
ABCC8 Q09428 1/20 0.39
KCNJ11 Q14654 1/20 0.39
KCNJ8 Q15842 1/20 0.39

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
SCHEMBL6936878 0.90 SLC9A1 (0.41) SLC9A1
SCHEMBL6936937 0.89 SLC9A1 (0.40) SLC9A1
SCHEMBL6938031 0.89 SLC9A1 (0.42) SLC9A1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6936925 0.89 SLC9A1 (0.42) SLC9A1
SCHEMBL6932260 0.89 SLC9A1 (0.49) SLC9A1
SCHEMBL6932315 0.84 SLC9A1 (0.40) SLC9A1
SCHEMBL6933133 0.84 SLC9A1 (0.52) SLC9A1
SCHEMBL7073340 0.84 HSD11B1 (0.40) SLC9A1
SCHEMBL6934853 0.83 PLAU (0.39) SLC9A1
SCHEMBL6932213 0.83 FLT1 (0.39)

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