SCHEMBL11087447

SCHEMBL11087447

NS(=O)(=O)c1cc(C(=O)SCCC(=O)O)ccc1Cl

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 20/20 0.61
▸ CA2 P00918 20/20 0.61
▸ CA7 P43166 3/20 0.53
▸ CA13 Q8N1Q1 3/20 0.53
▸ CA12 O43570 2/20 0.48
▸ CA6 P23280 2/20 0.48
▸ CA9 Q16790 1/20 0.48

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
SCHEMBL11309967 0.89 CA1 (0.51) CA1CA2CA7CA13CA12
SCHEMBL5508135 0.80 CA1 (0.67) CA1CA2CA7CA13CA12
SCHEMBL11079988 0.78 CA1 (0.57) CA1CA2CA7CA13
SCHEMBL11301698 0.78 CA1 (0.57) CA1CA2CA7CA13
SCHEMBL11079985 0.78 CA1 (0.57) CA1CA2CA7CA13
SCHEMBL11088267 0.78 CA1 (0.41) CA1CA2CA7CA13CA12
SCHEMBL11084329 0.78 CA2 (0.47) CA1CA2CA7CA13CA12
SCHEMBL329732 0.76 CA1 (0.63) CA1CA2CA7CA13CA12
SCHEMBL31670541 0.76 CA1 (0.63) CA1CA2CA7CA13CA12
SCHEMBL11090797 0.75 CA1 (0.51) CA1CA2CA7CA13CA12

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-4450275-A HYPOTENSIVE AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1984-05-22 — — US disclosed
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