SCHEMBL14200212

SCHEMBL14200212

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

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.34
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
CA14 Q9ULX7 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
SCHEMBL14200211 0.91
SCHEMBL14518426 0.83 CA1 (0.39) CA1CA12CA2CA14
SCHEMBL14200225 0.83 CA1 (0.39) CA1CA12CA2CA14
SCHEMBL14200214 0.81 CA1 (0.36) CA1CA12CA2CA14
SCHEMBL14200184 0.79 CA1 (0.48) CA1CA12CA2CA14
SCHEMBL14200183 0.77 CA1 (0.39) CA1CA12CA2CA14
SCHEMBL14200207 0.76 CA1 (0.38) CA1CA12CA2CA14
SCHEMBL14200208 0.74 CA1 (0.43) CA1CA12CA2CA14
SCHEMBL14201304 0.74 CA1 (0.36) CA1CA12CA2CA14
SCHEMBL14200221 0.74 CES1 (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 2 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-7208517-B1 Endothelin antagonists ABBOTT LABORTORIES (US) 2007-04-24 US disclosed