SCHEMBL5586201

SCHEMBL5586201

O=S(=O)(N(CCCCCCCCN(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F)C(F)(F)F

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA13 Q8N1Q1 1/20 0.30
EPHX1 P07099 1/20 0.30

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
SCHEMBL17509760 1.00 CA1 (0.30) CA1CA2CA7CA13EPHX1
SCHEMBL17865364 1.00 CA1 (0.30) CA1CA2CA7CA13EPHX1
SCHEMBL18574650 0.97 CA1 (0.32) CA1CA2CA7CA13
SCHEMBL5593702 0.92 CA1 (0.32) CA1CA2CA7CA13
SCHEMBL5586198 0.89 EPHX1 (0.46) EPHX1
SCHEMBL5586239 0.89 EPHX1 (0.46) EPHX1
SCHEMBL19853445 0.89
SCHEMBL18574542 0.89
SCHEMBL19099806 0.89 EPHX1 (0.46) EPHX1
SCHEMBL2203447 0.89 EPHX1 (0.46) EPHX1

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
WO-2007091817-A1 ANION RECEPTOR, AND ELECTROLYTE USING THE SAME KIM HEE JUNG (KR) 2007-08-16 WO claimed
WO-2007091817-A1 ANION RECEPTOR, AND ELECTROLYTE USING THE SAME KIM HEE JUNG (KR) 2007-08-16 WO disclosed