SCHEMBL586313

SCHEMBL586313

O=C(O)Cc1cc(Cl)cc(Oc2ccc(C(=O)c3ccc(F)cc3)cc2Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.47
PTGDR2 Q9Y5Y4 8/20 0.45
PTGDR Q13258 1/20 0.44
CHRM1 P11229 1/20 0.42
FFAR1 O14842 2/20 0.41
PTGER4 P35408 1/20 0.41
SRD5A2 P31213 3/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
EPAS1 Q99814 1/20 0.39

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
SCHEMBL10162766 0.81 EPAS1 (0.36) NR3C1PTGDR2PTGDRPTGER4LMNA
SCHEMBL586417 0.81 EPAS1 (0.40) PTGDR2PTGDRPTGER4EPAS1
SCHEMBL883831 0.80 EPAS1 (0.47) NR3C1PTGDR2PTGDRFFAR1EPAS1
SCHEMBL12777270 0.79 EPAS1 (0.39) PTGDR2PTGDRPTGER4EPAS1
SCHEMBL883851 0.79 FFAR1 (0.47) PTGDR2CHRM1FFAR1SRD5A2SMN1; SMN2
SCHEMBL4637504 0.77 SMN1; SMN2 (0.41) PTGER4SRD5A2LMNASMN1; SMN2L3MBTL1
SCHEMBL883850 0.76 PTGDR2 (0.48) NR3C1PTGDR2PTGDREPAS1
SCHEMBL586570 0.74 PTGDR2 (0.54) PTGDR2PTGDRFFAR1EPAS1
SCHEMBL883854 0.74 SRD5A2 (0.50) NR3C1PTGDR2FFAR1SRD5A2PPARG
SCHEMBL2065952 0.74 PTGDR2 (0.55) PTGDR2PTGDRFFAR1EPAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US claimed
US-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 US claimed
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
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-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 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
EP-1937632-A1 NOVEL COMPOUNDS Astra Zeneca AB (SE) 2008-07-02 EP disclosed
WO-2007039736-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-04-12 WO disclosed
WO-2007039736-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-04-12 WO 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 (2 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 NR3C1 523/4885PTGDR2 120/4885PTGDR 90/4885
US-20090192163-A1 Novel Compounds PAH, PC, DDC NR3C1 986/4885PTGDR2 1000/4885PTGDR 859/4885

“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.