SCHEMBL13684271

SCHEMBL13684271

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

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 17/20 0.53
CA1 P00915 16/20 0.53
CA7 P43166 2/20 0.53
CA13 Q8N1Q1 1/20 0.53
F2 P00734 3/20 0.39
PRSS1 P07477 3/20 0.39
PRSS2 P07478 3/20 0.39
PRSS3 P35030 3/20 0.39
MMP1 P03956 2/20 0.39
MMP2 P08253 2/20 0.39
MMP9 P14780 2/20 0.39
MMP8 P22894 2/20 0.39
MMP13 P45452 2/20 0.39
CA9 Q16790 4/20 0.33
CA5A P35218 2/20 0.33
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA5B Q9Y2D0 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
SCHEMBL867460 0.97 CA2 (0.56) CA2CA1CA7CA13F2
SCHEMBL4463838 0.93 CA2 (0.53) CA2CA1CA7CA13F2
SCHEMBL5188600 0.91 CA2 (0.54) CA2CA1CA7CA13F2
SCHEMBL828147 0.91 CA2 (0.54) CA2CA1CA7CA13F2
SCHEMBL31520150 0.91 CA2 (0.54) CA2CA1CA7CA13F2
SCHEMBL29263304 0.91 CA2 (0.54) CA2CA1CA7CA13F2
SCHEMBL4937413 0.91 CA2 (0.54) CA2CA1CA7CA13F2
SCHEMBL29831834 0.91 CA2 (0.54) CA2CA1CA7CA13F2
SCHEMBL4289615 0.90 CA2 (0.56) CA2CA1CA7CA13F2
Ammonia Solution, Strong SCHEMBL31424949 0.89 CA2 (0.52) CA2CA1CA7CA13F2

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
US-7592375-B2 Ion conductive polymers and imide monomers KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2009-09-22 US disclosed