SCHEMBL6934404

SCHEMBL6934404

CCCC(C)S(=O)(=O)c1cc(C)c(C(=O)N=C(N)N)cc1C(F)(F)F

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.52

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
SCHEMBL6938087 0.91 SLC9A1 (0.54) SLC9A1
SCHEMBL6935227 0.89 SLC9A1 (0.38) SLC9A1
SCHEMBL6930558 0.86 SLC9A1 (0.59) SLC9A1
SCHEMBL6934527 0.85 SLC9A1 (0.52) SLC9A1
SCHEMBL6938131 0.84 SLC9A1 (0.71) SLC9A1
SCHEMBL8544918 0.83 POLB (0.31)
SCHEMBL6935096 0.83 SLC9A1 (0.57) SLC9A1
SCHEMBL6936927 0.82 SLC9A1 (0.53) SLC9A1
SCHEMBL6935900 0.80 SLC9A1 (0.51) SLC9A1
SCHEMBL8538512 0.80 SLC9A1 (0.40) 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