SCHEMBL1651017

SCHEMBL1651017

O=S(=O)(Cc1ccccn1)c1ccc(Oc2cc(Cc3nnn[nH]3)cc(C(F)(F)F)c2)c(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
KMT2A Q03164 1/20 0.33
EPAS1 Q99814 1/20 0.33
TP53 P04637 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MRGPRX4 Q96LA9 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31
PTGDR2 Q9Y5Y4 2/20 0.31
PDK1 Q15118 1/20 0.30
PDK2 Q15119 1/20 0.30
PDK3 Q15120 1/20 0.30
PDK4 Q16654 1/20 0.30

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
SCHEMBL1651357 0.90 KMT2A (0.35) TRPM8KMT2AEPAS1MRGPRX4SPHK1
SCHEMBL1649790 0.87 EPAS1 (0.35) KMT2AEPAS1
SCHEMBL1649788 0.85 EPAS1 (0.38) ALDH1A1TRPM8EPAS1TP53MRGPRX4
SCHEMBL1653517 0.85 EPAS1 (0.36) ALDH1A1KMT2AEPAS1MRGPRX4
SCHEMBL1651101 0.83 PTGDR2 (0.39) KMT2AEPAS1MRGPRX4PTGDR2
SCHEMBL883836 0.82 PTGDR2 (0.42) GAAALDH1A1LMNATRPM8KMT2A
SCHEMBL1653612 0.81 EPAS1 (0.36) ALDH1A1LMNAKMT2AEPAS1SMN1; SMN2
SCHEMBL1651662 0.80 SPHK1 (0.33) KMT2ASPHK1PTGDR2
SCHEMBL4835933 0.80 EPAS1 (0.33) EPAS1
SCHEMBL4835936 0.79 EPAS1 (0.35) EPAS1

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 9 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 claimed
US-20080293775-A1 Substituted Diphenylethers, -Amines, -Sulfides and -Methanes for the Treatment of Respiratory Disease ASTRAZENECA AB (SE) 2008-11-27 US claimed
EP-1963259-A2 SUBSTITUTED DIPHENYLETHERS, -AMINES, -SULFIDES AND -METHANES FOR THE TREATMENT OF RESPIRATORY DISEASE AstraZeneca AB (SE) 2008-09-03 EP claimed
WO-2007068894-A2 SUBSTITUTED DIPHENYLETHERS, -AMINES, -SULFIDES AND -METHANES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2007-06-21 WO claimed
EP-2305640-A2 Substituted diphenyl-ethers, -amines, -sulfides and -methanes for the treatment of respiratory diseases AstraZeneca AB (SE) 2011-04-06 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
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 GAA 2850/4885ALDH1A1 1390/4885LMNA 2765/4885

“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.