SCHEMBL5477381

SCHEMBL5477381

CS(=O)(=O)c1ccc(-c2c(Cl)ccc(OCC(=O)O)c2N)cc1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 17/20 0.53
TDP1 Q9NUW8 2/20 0.42
ACLY P53396 1/20 0.42
TSHR P16473 1/20 0.41

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
SCHEMBL1753560 0.75 PTGDR2 (0.80) PTGDR2
SCHEMBL1753457 0.73 PTGDR2 (0.62) PTGDR2TDP1ACLY
SCHEMBL13261514 0.71 PTGDR2 (0.80) PTGDR2
SCHEMBL1333281 0.71 PTGDR2 (0.65) PTGDR2TDP1TSHR
SCHEMBL12147216 0.71 PTGDR2 (0.82) PTGDR2TDP1TSHR
SCHEMBL1332553 0.70 PTGDR2 (0.63) PTGDR2TDP1TSHR
SCHEMBL12852975 0.70 TDP1 (0.56) PTGDR2TDP1TSHR
SCHEMBL5959337 0.69 PTGDR2 (0.48) PTGDR2TDP1TSHR
SCHEMBL1331609 0.69 PTGDR2 (0.62) PTGDR2TDP1TSHR
SCHEMBL4975267 0.69 PTGDR2 (1.00) 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
JP-2007502806-A 2007-02-15 JP claimed
EP-1660431-A2 PHENOXYACETIC ACID DERIVATIVES Astrazeneca AB (SE) 2006-05-31 EP claimed
WO-2005018529-A2 PHENOXIACETIC ACID DERIVATIVES ASTRAZENECA AB (SE) 2005-03-03 WO claimed