SCHEMBL10162776

SCHEMBL10162776

CCCS(=O)(=O)NC(=O)Cc1cc(Cl)cc(Oc2ccc(S(C)(=O)=O)cc2Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 10/20 0.44
EPAS1 Q99814 4/20 0.41
PTGDR Q13258 1/20 0.38
EGFR P00533 2/20 0.38
ERBB2 P04626 2/20 0.38
RORC P51449 2/20 0.36
SCN9A Q15858 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
SCHEMBL10162653 0.93 PTGDR2 (0.45) PTGDR2EPAS1PTGDREGFRERBB2
SCHEMBL586217 0.92 PTGDR2 (0.44) PTGDR2EPAS1PTGDREGFRERBB2
SCHEMBL585800 0.90 EPAS1 (0.46) PTGDR2EPAS1PTGDREGFRERBB2
SCHEMBL585990 0.88 PTGDR2 (0.44) PTGDR2EPAS1RORC
SCHEMBL10162778 0.87 PTGDR2 (0.41) PTGDR2EPAS1PTGDREGFRERBB2
SCHEMBL585797 0.85 PTGDR2 (0.45) PTGDR2EPAS1PTGDREGFRERBB2
SCHEMBL585493 0.83 EPAS1 (0.42) PTGDR2EPAS1EGFRERBB2RORC
SCHEMBL586570 0.82 PTGDR2 (0.54) PTGDR2EPAS1PTGDR
SCHEMBL14490991 0.81 EPAS1 (0.47) PTGDR2EPAS1PTGDR
SCHEMBL585257 0.81 PTGDR2 (0.46) PTGDR2EPAS1RORCSCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963259-B1 SUBSTITUTED DIPHENYLETHERS, -AMINES, -SULFIDES AND -METHANES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2012-02-15 EP disclosed
EP-2305640-A2 Substituted diphenyl-ethers, -amines, -sulfides and -methanes for the treatment of respiratory diseases AstraZeneca AB (SE) 2011-04-06 EP disclosed
US-20080293775-A1 Substituted Diphenylethers, -Amines, -Sulfides and -Methanes for the Treatment of Respiratory Disease ASTRAZENECA AB (SE) 2008-11-27 US 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 PTGDR2 120/4885EPAS1 299/4885PTGDR 90/4885

“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.