SCHEMBL14201304

SCHEMBL14201304

CCCN(CCC(C)(C)C)S(=O)(=O)CCC(C)C

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.36
CA12 O43570 2/20 0.34
CA14 Q9ULX7 2/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 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
SCHEMBL14200390 0.90 TP53 (0.32) CA2
SCHEMBL14200424 0.86
SCHEMBL14200208 0.84 CA1 (0.43) CA1CA12CA14CA2CA7
SCHEMBL14200183 0.83 CA1 (0.39) CA1CA12CA14CA2CA7
SCHEMBL14200413 0.83 PIK3CD (0.36)
SCHEMBL14200184 0.82 CA1 (0.48) CA1CA12CA14CA2CA7
SCHEMBL14201305 0.81 CA1 (0.40) CA1CA12CA14CA2CA7
SCHEMBL14229375 0.81 CA1 (0.40) CA1CA12CA14CA2
SCHEMBL14200353 0.79 CA1 (0.39) CA1CA12CA14CA2CA7
SCHEMBL14200430 0.79 CNR2 (0.33)

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
US-7365093-B2 Endothelin antagonists ABBOTT LABORATORIES (US) 2008-04-29 US disclosed
US-7365093-B2 Endothelin antagonists ABBOTT LABORATORIES (US) 2008-04-29 US disclosed
US-7208517-B1 Endothelin antagonists ABBOTT LABORTORIES (US) 2007-04-24 US disclosed