SCHEMBL1650259

SCHEMBL1650259

NS(=O)(=O)Cc1cc(O)cc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A9 P06702 7/20 0.42
CA1 P00915 5/20 0.41
CA2 P00918 5/20 0.41
CA9 Q16790 4/20 0.41
CA5A P35218 1/20 0.41
HCAR1 Q9BXC0 1/20 0.38
ENPP2 Q13822 1/20 0.38
IDO1 P14902 2/20 0.36
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
PIK3CA P42336 1/20 0.35
KMT2A Q03164 1/20 0.35
F2 P00734 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
CA12 O43570 1/20 0.33

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
SCHEMBL4882959 0.86 CA1 (0.48) S100A9CA1CA2CA9CA5A
SCHEMBL31382831 0.78 TP53 (0.46) S100A9CA1CA2CA9CA5A
SCHEMBL11062475 0.77 CA1 (0.42) S100A9CA1CA2CA9CA5A
SCHEMBL1650853 0.73 MEN1 (0.39) CA1CA2CA9CA5AMEN1
SCHEMBL2451874 0.73 PNMT (0.46) HCAR1ENPP2IDO1CYP3A4HPGD
SCHEMBL1644190 0.71 CA1 (0.57) S100A9CA1CA2CA9CA5A
SCHEMBL1651345 0.71 CA2 (0.50) CA2HCAR1IDO1MEN1CYP3A4
SCHEMBL12826275 0.70 ACHE (0.67) HCAR1IDO1MEN1CYP3A4MAPT
SCHEMBL31168034 0.69 CA1 (0.45) S100A9CA1CA2CA9CA5A
SCHEMBL15088205 0.69 APLNR (0.48) CA1CA2CA9CA5AHCAR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2305640-A2 Substituted diphenyl-ethers, -amines, -sulfides and -methanes for the treatment of respiratory diseases AstraZeneca AB (SE) 2011-04-06 EP disclosed
CN-101374804-A Substituted diphenylethers, -amines, -sulfides and -methanes for the treatment of respiratory disease ASTRAZENECA AB (SE) 2009-02-25 CN disclosed
US-20080293775-A1 Substituted Diphenylethers, -Amines, -Sulfides and -Methanes for the Treatment of Respiratory Disease ASTRAZENECA AB (SE) 2008-11-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080293775-A1 Substituted Diphenylethers, -Amines, -Sulfides and -Methanes for the Treatment of Respiratory Disease PNMT, SQOR, SMS S100A9 1937/4885CA1 4512/4885CA2 3697/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.