SCHEMBL11090797

SCHEMBL11090797

C[C@@H](CSC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C(=O)Cl

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 19/20 0.51
▸ CA2 P00918 19/20 0.51
▸ CA7 P43166 4/20 0.47
▸ CA13 Q8N1Q1 4/20 0.47
▸ CA12 O43570 3/20 0.46
▸ CA6 P23280 3/20 0.46
▸ CA9 Q16790 1/20 0.46

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
SCHEMBL11090781 1.00 CA1 (0.51) CA1CA2CA7CA13CA12
SCHEMBL11301698 0.90 CA1 (0.57) CA1CA2CA7CA13
SCHEMBL11079985 0.90 CA1 (0.57) CA1CA2CA7CA13
SCHEMBL11079988 0.90 CA1 (0.57) CA1CA2CA7CA13
SCHEMBL11309967 0.78 CA1 (0.51) CA1CA2CA7CA13CA12
SCHEMBL11084531 0.77 CA2 (0.44) CA1CA2
SCHEMBL11089460 0.77 ACE (0.45) CA1CA2
SCHEMBL11084537 0.77 CA2 (0.44) CA1CA2
SCHEMBL11089449 0.77 ACE (0.45) CA1CA2
SCHEMBL11087447 0.75 CA1 (0.61) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56083419-A — — None — — JP disclosed
US-4450275-A HYPOTENSIVE AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1984-05-22 — — US disclosed
JP-S5683419-A REMEDY FOR HYPERTENSION YOSHITOMI PHARMACEUT IND LTD 1981-07-08 — — JP disclosed
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