SCHEMBL1713852

SCHEMBL1713852

CC(=O)Oc1ccc(Cl)cc1CN1CCN(S(=O)(=O)Cc2ccccn2)CC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 11/20 0.58
F10 P00742 1/20 0.44
KMT2A Q03164 1/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42

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
SCHEMBL1713850 0.87 PTGDR2 (0.78) PTGDR2
SCHEMBL1714674 0.83 PTGDR2 (0.60) PTGDR2KMT2AKDM4EALDH1A1
SCHEMBL1713829 0.74 PTGDR2 (1.00) PTGDR2KMT2A
SCHEMBL13800236 0.74 PTGDR2 (0.55) PTGDR2KDM4EALDH1A1
SCHEMBL4608065 0.72 PTGDR2 (0.73) PTGDR2
SCHEMBL5201562 0.72 PTGDR2 (0.73) PTGDR2
SCHEMBL1714137 0.71 PTGDR2 (1.00) PTGDR2KMT2A
SCHEMBL1714591 0.71 PTGDR2 (0.81) PTGDR2
SCHEMBL1714586 0.71 PTGDR2 (0.90) PTGDR2
SCHEMBL1715064 0.70 PTGDR2 (0.89) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1817282-B1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2011-07-20 EP claimed
EP-1817282-A1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES AstraZeneca AB (SE) 2007-08-15 EP claimed
WO-2006056752-A1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2006-06-01 WO claimed
EP-1817282-B1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2011-07-20 EP disclosed
EP-1817282-A1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES AstraZeneca AB (SE) 2007-08-15 EP disclosed
WO-2006056752-A1 PHENOXYACETIC ACID DERIVATIVES USEFUL FOR TREATING RESPIRATORY DISEASES ASTRAZENECA AB (SE) 2006-06-01 WO disclosed