SCHEMBL5315009

SCHEMBL5315009

O=C(O)COc1ccc(Br)cc1C(=O)c1cnn(-c2c(Cl)cnc(O)c2Cl)c1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 19/20 0.69

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
SCHEMBL1997071 0.89 PTGDR2 (0.76) PTGDR2
SCHEMBL1992159 0.87 PTGDR2 (0.75) PTGDR2
SCHEMBL1993265 0.87 PTGDR2 (0.77) PTGDR2
SCHEMBL1993048 0.84 PTGDR2 (0.75) PTGDR2
SCHEMBL5339072 0.83 PTGDR2 (0.69) PTGDR2
SCHEMBL1997245 0.83 PTGDR2 (0.69) PTGDR2
SCHEMBL1996124 0.82 PTGDR2 (0.82) PTGDR2
SCHEMBL1995532 0.82 PTGDR2 (0.82) PTGDR2
SCHEMBL1993593 0.82 PTGDR2 (1.00) PTGDR2
SCHEMBL5313369 0.81 PTGDR2 (0.74) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007062678-A1 PHENOXYACETIC ACID DERIVATIVES AS CRTH2 RECEPTOR LIGANDS 7TM PHARMA A/S (DK) 2007-06-07 WO claimed
WO-2007062678-A1 PHENOXYACETIC ACID DERIVATIVES AS CRTH2 RECEPTOR LIGANDS 7TM PHARMA A/S (DK) 2007-06-07 WO disclosed
WO-2007062678-A1 PHENOXYACETIC ACID DERIVATIVES AS CRTH2 RECEPTOR LIGANDS 7TM PHARMA A/S (DK) 2007-06-07 WO disclosed