SCHEMBL4608065

SCHEMBL4608065

CC(=O)Oc1ccc(Cl)cc1CN1CCN(S(=O)(=O)Cc2ccccc2)[C@@H](C)C1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 20/20 0.73

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
SCHEMBL5201562 1.00 PTGDR2 (0.73) PTGDR2
SCHEMBL1714363 0.88 PTGDR2 (0.77) PTGDR2
SCHEMBL1714717 0.88 PTGDR2 (0.77) PTGDR2
SCHEMBL1714826 0.88 PTGDR2 (0.77) PTGDR2
SCHEMBL1714650 0.87 PTGDR2 (0.78) PTGDR2
SCHEMBL5199825 0.87 PTGDR2 (0.78) PTGDR2
SCHEMBL4608060 0.84 PTGDR2 (1.00) PTGDR2
SCHEMBL27748339 0.83 PTGDR2 (0.78) PTGDR2
SCHEMBL1713552 0.83 PTGDR2 (0.78) PTGDR2
SCHEMBL4622645 0.83 PTGDR2 (0.83) PTGDR2

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-1948630-A2 NOVEL COMPOUNDS AstraZeneca AB (SE) 2008-07-30 EP claimed
EP-1817282-A1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES AstraZeneca AB (SE) 2007-08-15 EP claimed
WO-2007052023-A2 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-05-10 WO claimed
WO-2006056752-A1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2006-06-01 WO claimed