SCHEMBL8664584

SCHEMBL8664584

C=C(CC)c1cc(CC)c(C(=O)Cl)cc1S(C)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.31

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
SCHEMBL8665237 0.87 SLC9A1 (0.31) SLC9A1
SCHEMBL8664932 0.85 SLC9A1 (0.39) SLC9A1
SCHEMBL8538752 0.82 SLC9A1 (0.39) SLC9A1
SCHEMBL8667426 0.81 SLC9A1 (0.31) SLC9A1
SCHEMBL7798622 0.80 SLC9A1 (0.53) SLC9A1
SCHEMBL8663582 0.79 SLC9A1 (0.31) SLC9A1
SCHEMBL8663580 0.79 SLC9A1 (0.31) SLC9A1
SCHEMBL8542805 0.77 SLC9A1 (0.36) SLC9A1
SCHEMBL8667251 0.77 SMN1; SMN2 (0.34) SLC9A1
SCHEMBL8667565 0.77 SLC9A1 (0.31) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5731351-A Alkenyl-benzoylguanidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-03-24 US disclosed