SCHEMBL5387735

SCHEMBL5387735

CS(=O)(=O)c1ccc(Oc2ccccc2O)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.47
STK39 Q9UEW8 1/20 0.45
TTR P02766 3/20 0.45
LMNA P02545 2/20 0.45
NR1I2 O75469 1/20 0.45
PGR P06401 1/20 0.45
HSP90AA1 P07900 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
MAPT P10636 1/20 0.45
HSPA5 P11021 1/20 0.45
HPGD P15428 1/20 0.45
CBR1 P16152 1/20 0.45
TBXA2R P21731 1/20 0.45
SLC6A2 P23975 1/20 0.45
AGTR1 P30556 1/20 0.45
SLC6A3 Q01959 1/20 0.45
PTGS1 P23219 2/20 0.44
BRD4 O60885 1/20 0.43
PTGDR2 Q9Y5Y4 2/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL3929614 0.85 EPAS1 (0.44) PTGS2SLC6A2SLC6A3PTGS1BRD4
SCHEMBL1331564 0.84 PTGS2 (0.52) PTGS2TTRLMNANR1I2PGR
SCHEMBL5387729 0.84 PTGS2 (0.48) PTGS2LMNAMAPTPTGS1BRD4
SCHEMBL5397109 0.84 TTR (0.50) PTGS2TTRLMNANR1I2PGR
SCHEMBL3930211 0.80 PTGS2 (0.49) PTGS2TTRLMNANR1I2PGR
SCHEMBL1654842 0.79 PTGDR2 (0.54) TTRBRD4PTGDR2
SCHEMBL1331609 0.79 PTGDR2 (0.62) PTGDR2SMN1; SMN2
SCHEMBL240470 0.76 TTR (0.76) STK39TTRLMNANR1I2PGR
SCHEMBL5397099 0.76 PTGS2 (0.46) PTGS2LMNAPTGS1BRD4PTGDR2
SCHEMBL3929611 0.74 EPAS1 (0.45) PTGS2HPGDSLC6A2SLC6A3PTGS1

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 5 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
EP-1660431-A2 PHENOXYACETIC ACID DERIVATIVES Astrazeneca AB (SE) 2006-05-31 EP disclosed
WO-2005018529-A2 PHENOXIACETIC ACID DERIVATIVES ASTRAZENECA AB (SE) 2005-03-03 WO disclosed