SCHEMBL4573032

SCHEMBL4573032

CN(C(=O)O)C1CSc2sc(S(N)(=O)=O)cc2C1=O

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA2 P00918 20/20 0.46
CA1 P00915 2/20 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
SCHEMBL14155516 0.87 CA2 (0.43) CA2
SCHEMBL4574405 0.78 CA2 (0.36) CA2
SCHEMBL4573497 0.78 CA2 (0.36) CA2
SCHEMBL10514135 0.74 CA2 (0.54) CA2
SCHEMBL4573053 0.74 CA2 (0.50) CA2CA1
SCHEMBL4573030 0.73 CA2 (0.44) CA2
Bromide SCHEMBL4574420 0.73 CA2 (0.49) CA2CA1
SCHEMBL14155538 0.72 CA2 (0.42) CA2CA1
SCHEMBL10539035 0.71 CA2 (0.50) CA2
SCHEMBL4573335 0.70 HPGD (0.37)

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
WO-2008075148-A2 TRICYCLIC INHIBITORS OF CARBONIC ANHYDRASE PFIZER PRODUCTS INC. (US) 2008-06-26 WO disclosed