SCHEMBL8664579

SCHEMBL8664579

Cc1cc(C2C=CCC2)c(S(C)(=O)=O)cc1C(=O)Cl

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 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
SCHEMBL8664678 0.93 SLC9A1 (0.38) SLC9A1
SCHEMBL8665276 0.85 SLC9A1 (0.32) SLC9A1
SCHEMBL7793133 0.82 SLC9A1 (0.61) SLC9A1
SCHEMBL8667613 0.81 SLC9A1 (0.38) SLC9A1
SCHEMBL8664547 0.80 SLC9A1 (0.48) SLC9A1
SCHEMBL8668878 0.79 GAA (0.36)
SCHEMBL8663780 0.77 SLC9A1 (0.39) SLC9A1
SCHEMBL7798473 0.76 SLC9A1 (0.59) SLC9A1
SCHEMBL6719348 0.74 SLC9A1 (0.57) SLC9A1
SCHEMBL8664471 0.72 KMT2A (0.34)

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