SCHEMBL15529918

SCHEMBL15529918

[CH2]CS(=O)(=O)CCOS(N)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 20/20 0.50
CA1 P00915 18/20 0.50
CA9 Q16790 16/20 0.50
CA12 O43570 5/20 0.48
CA7 P43166 5/20 0.48
CA14 Q9ULX7 5/20 0.48
CA3 P07451 4/20 0.48
CA4 P22748 4/20 0.48
CA6 P23280 4/20 0.48
CA5A P35218 4/20 0.48
CA5B Q9Y2D0 4/20 0.48

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
SCHEMBL15529727 0.76 USP2 (0.50)
SCHEMBL7772023 0.74 CA2 (0.60) CA2CA1CA9CA12CA7
SCHEMBL11338633 0.73 CA2 (0.75) CA2CA1CA9CA12CA7
SCHEMBL13934362 0.70 CA1 (0.56) CA2CA1CA9CA12CA7
SCHEMBL4698201 0.70
SCHEMBL11593779 0.68 CA2 (0.88) CA2CA1CA9CA12CA7
SCHEMBL11593067 0.68 CA1 (1.00) CA2CA1CA9CA12CA7
SCHEMBL7512081 0.66
SCHEMBL11592779 0.66 CA1 (1.00) CA2CA1CA9CA12CA7
SCHEMBL11595306 0.66 CA1 (1.00) CA2CA1CA9CA12CA7

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-2013167297-A2 METHOD FOR SHAPING KERATINOUS FIBERS HENKEL AG & CO. KGAA (DE) 2013-11-14 WO disclosed