SCHEMBL11444012

SCHEMBL11444012

C=CCS(=O)(=O)OCCCl

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.35
CA9 Q16790 1/20 0.35
CA1 P00915 1/20 0.32

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
SCHEMBL5571534 0.85 CA2 (0.41) CA2CA9
SCHEMBL5570901 0.81 CA2 (0.38) CA2CA9CA1
SCHEMBL5571536 0.81 CA2 (0.40) CA2CA9CA1
SCHEMBL10487652 0.79 CA2 (0.37) CA2CA9
SCHEMBL5570905 0.79 CA2 (0.42) CA2CA9CA1
SCHEMBL5570908 0.79 CA2 (0.42) CA2CA9CA1
SCHEMBL5572565 0.79 CA2 (0.42) CA2CA9CA1
SCHEMBL5571069 0.79 CA2 (0.42) CA2CA9CA1
SCHEMBL4881310 0.77 CA2 (0.44) CA2CA9CA1
SCHEMBL22129572 0.76 CA2 (0.43) CA2CA9CA1

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
EP-0001740-B1 PROCESS FOR THE MANUFACTURE OF 3-HALOALKOXY- AND 3-HYDROXYALKOXY-2-ALKYLPROPIONIC ACIDS ESTERS BRACCO INDUSTRIA CHIMICA Società per Azioni (IT) 1980-09-03 EP claimed