SCHEMBL9810165

SCHEMBL9810165

NS(=O)(=O)c1ccc2c(c1)S(=O)(=O)[N]C=N2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 14/20 0.46
CA2 P00918 14/20 0.46
CA9 Q16790 11/20 0.46
CA12 O43570 7/20 0.42
CA7 P43166 5/20 0.42
GLO1 Q04760 1/20 0.42
ALOX5 P09917 2/20 0.41
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
CA14 Q9ULX7 4/20 0.38
CA4 P22748 2/20 0.36
CA6 P23280 2/20 0.36
CA5A P35218 2/20 0.36
CA5B Q9Y2D0 2/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL17350894 0.73 CA1 (0.48) CA1CA2CA9CA12CA7
SCHEMBL4024315 0.67 CA1 (0.53) CA1CA2CA9CA12CA7
SCHEMBL5625166 0.65 CA1 (0.56) CA1CA2CA9CA12CA7
SCHEMBL17350895 0.64 CA1 (0.57) CA1CA2CA9CA12CA7
SCHEMBL8024515 0.63 CA2 (1.00) CA1CA2CA9CA12CA7
SCHEMBL17395951 0.62 CA1 (0.50) CA1CA2CA9CA12CA7
SCHEMBL210441 0.62 CA1 (0.34) CA1CA2CA9CA12CA7
SCHEMBL209432 0.62 CHEK1 (0.36) CA1CA2CA9CA12CA7
SCHEMBL28174280 0.61 PNMT (0.50) CA1CA2CA9CA12CA7
SCHEMBL6297784 0.61 CA2 (0.82) CA1CA2CA9CA12CA7

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-5017567-A Steroid antiinflammatory SCHERING CORPORATION (US) 1991-05-21 US disclosed