SCHEMBL1714383

SCHEMBL1714383

CC(=O)Oc1ccc(Cl)cc1CN1CCN(S(=O)(=O)c2ccccc2)CC1C

nearest known ligand 0.78

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 12/20 0.78
KCNT1 Q5JUK3 3/20 0.43
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL27833995 0.91 PTGDR2 (0.76) PTGDR2KCNT1TP53ALDH1A1
SCHEMBL1713928 0.88 PTGDR2 (1.00) PTGDR2
SCHEMBL1714382 0.88 PTGDR2 (1.00) PTGDR2
SCHEMBL27712976 0.84 PTGDR2 (0.71) PTGDR2ALDH1A1
SCHEMBL27693395 0.84 PTGDR2 (0.71) PTGDR2ALDH1A1
SCHEMBL1714650 0.81 PTGDR2 (0.78) PTGDR2
SCHEMBL5199825 0.81 PTGDR2 (0.78) PTGDR2
SCHEMBL5200411 0.77 PTGDR2 (0.49) PTGDR2POLB
SCHEMBL1714294 0.75 PTGDR2 (0.77) PTGDR2
SCHEMBL5264635 0.74 PTGDR2 (0.75) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101107226-B Phenoxyacetic acid derivatives useful for treating respiratory diseases ASTRAZENECA AB 2012-01-18 CN claimed
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
CN-101107226-B Phenoxyacetic acid derivatives useful for treating respiratory diseases ASTRAZENECA AB 2012-01-18 CN disclosed
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