SCHEMBL5200959

SCHEMBL5200959

CC(=O)Oc1ccc(Cl)cc1CN1CCN(C(=O)Cc2cccnc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.59
FNTA P49354 10/20 0.55
FNTB P49356 10/20 0.55
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 2/20 0.53
PKM P14618 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GRM5 P41594 1/20 0.46
ATM Q13315 1/20 0.46
ALOX15 P16050 1/20 0.46

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
SCHEMBL27833957 0.91 PTGDR2 (0.57) PTGDR2FNTAFNTBKDM4EALDH1A1
SCHEMBL1713822 0.86 PTGDR2 (0.80) PTGDR2FNTAFNTBKDM4EALDH1A1
SCHEMBL27693175 0.84 FNTA (0.61) PTGDR2FNTAFNTBKDM4EALDH1A1
SCHEMBL1714674 0.83 PTGDR2 (0.60) PTGDR2KDM4EALDH1A1PKMKMT2A
SCHEMBL1714922 0.83 PTGDR2 (0.61) PTGDR2KDM4EALDH1A1PKMMEN1
SCHEMBL27852039 0.82 PTGDR2 (0.60) PTGDR2KDM4EALDH1A1PKMMEN1
SCHEMBL1714226 0.82 PTGDR2 (0.60) PTGDR2KDM4EALDH1A1PKMMEN1
SCHEMBL1713882 0.80 PTGDR2 (0.57) PTGDR2KDM4EALDH1A1PKMMEN1
SCHEMBL27852040 0.74 PTGDR2 (0.59) PTGDR2KDM4EALDH1A1PKMMEN1
SCHEMBL1713552 0.74 PTGDR2 (0.78) 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 4 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-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