SCHEMBL6583531

SCHEMBL6583531

COc1ccc(C2CCNC(=O)O2)cc1OCCOCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 5/20 0.49
PDE4B Q07343 3/20 0.49
PDE4C Q08493 3/20 0.49
PDE4D Q08499 3/20 0.49
LMNA P02545 1/20 0.40
PTAFR P25105 8/20 0.39
SIRT2 Q8IXJ6 1/20 0.38
PDE1C Q14123 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
REN P00797 1/20 0.38
APP P05067 1/20 0.37

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
SCHEMBL6584193 0.89 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DPTAFR
SCHEMBL6582690 0.87 PTAFR (0.48) PDE4APDE4BPDE4CPDE4DPTAFR
SCHEMBL6583051 0.85 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL6587870 0.83 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL6583522 0.82 ACHE (0.45)
SCHEMBL6583511 0.82 PDE4B (0.44) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL6584131 0.81 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DPTAFR
SCHEMBL6585391 0.80 ACHE (0.42) PDE4APDE4BPDE4CPDE4DPTAFR
SCHEMBL7913451 0.80 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DSIRT2
SCHEMBL11430072 0.80 PDE4A (0.64) PDE4APDE4BPDE4CPDE4DLMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0928789-B1 6-PHENYLTETRAHYDRO-1,3-OXAZIN-2-ONE DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME NIKKEN CHEMICALS CO LTD (JP) 2004-09-29 EP disclosed
US-6251897-B1 TREATING DERMATITIS, ASTHMA NIKKEN CHEMICALS CO., LTD (JP) 2001-06-26 US disclosed
EP-0928789-A1 6-PHENYLTETRAHYDRO-1,3-OXAZIN-2-ONE DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Nikken Chemicals Company, Limited (JP) 1999-07-14 EP disclosed