SCHEMBL1714922

SCHEMBL1714922

CC(=O)Oc1ccc(Cl)cc1CN1CCN(C(=O)Cc2ccc(C)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.61
LMNA P02545 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
KDM4E B2RXH2 4/20 0.49
ALDH1A1 P00352 3/20 0.49
PKM P14618 1/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
ATM Q13315 2/20 0.47
ALOX15 P16050 1/20 0.47
GAA P10253 1/20 0.46
TDP1 Q9NUW8 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
SCHEMBL1714226 0.91 PTGDR2 (0.60) PTGDR2KDM4EALDH1A1PKMMEN1
SCHEMBL27852039 0.91 PTGDR2 (0.60) PTGDR2LMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL1713882 0.88 PTGDR2 (0.57) PTGDR2SMN1; SMN2KDM4EALDH1A1PKM
SCHEMBL1713709 0.86 PTGDR2 (0.83) PTGDR2LMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL5200959 0.83 PTGDR2 (0.59) PTGDR2KDM4EALDH1A1PKMMEN1
SCHEMBL27852040 0.82 PTGDR2 (0.59) PTGDR2LMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL27852058 0.81 PTGDR2 (0.58) PTGDR2KDM4EALDH1A1PKMMEN1
SCHEMBL5198743 0.81 MEN1 (0.41) PTGDR2KDM4EALDH1A1MEN1KMT2A
SCHEMBL3939170 0.79 PTGDR2 (0.61) PTGDR2LMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL1714400 0.79 PTGDR2 (0.90) PTGDR2ATM

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 1 patent. 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 disclosed