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Sugi Predict / Compounds / SCHEMBL4792091

SCHEMBL4792091

SCHEMBL4792091

CCS(=O)(=O)c1ccc(Oc2cc(Cl)cc(CC(=O)N(c3ccccc3)S(=O)(=O)CC)c2)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 14/20 0.43
▸ EPAS1 Q99814 2/20 0.38
▸ PTGDR Q13258 1/20 0.37
▸ RORC P51449 1/20 0.37

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
SCHEMBL2065952 0.84 PTGDR2 (0.55) PTGDR2EPAS1PTGDR
SCHEMBL1650643 0.81 PTGDR2 (0.46) PTGDR2EPAS1PTGDR
SCHEMBL585797 0.77 PTGDR2 (0.45) PTGDR2EPAS1PTGDRRORC
SCHEMBL2066232 0.77 PTGDR2 (0.50) PTGDR2EPAS1PTGDR
SCHEMBL586217 0.77 PTGDR2 (0.44) PTGDR2EPAS1PTGDRRORC
SCHEMBL586266 0.76 PTGDR2 (0.46) PTGDR2RORC
SCHEMBL2066535 0.74 PTGDR2 (0.54) PTGDR2EPAS1PTGDR
SCHEMBL4674539 0.74 PTGDR2 (0.48) PTGDR2PTGDR
SCHEMBL883837 0.74 PTGDR2 (0.48) PTGDR2PTGDR
SCHEMBL885411 0.74 PTGDR2 (0.48) PTGDR2PTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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