SCHEMBL6584923

SCHEMBL6584923

COc1ccc(C2CCNC(=O)O2)cc1OC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.49
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
PDE4B Q07343 3/20 0.45
ACHE P22303 2/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
SIGMAR1 Q99720 1/20 0.43
BACE1 P56817 1/20 0.43

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
SCHEMBL6583522 0.85 ACHE (0.45) ACHE
SCHEMBL6585936 0.82 PDE4B (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL6585932 0.82 PDE4B (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL6584973 0.82 PDE4B (0.65) PDE4APDE4BPDE4CPDE4D
SCHEMBL6585044 0.80 PDE4B (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL6584193 0.79 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DSIGMAR1
SCHEMBL6584131 0.78 PDE4A (0.49) PDE4APDE4BACHEPDE4CPDE4D
SCHEMBL6582690 0.77 PTAFR (0.48) PDE4APDE4BPDE4CPDE4D
SCHEMBL6584854 0.76 PDE4D (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL6583531 0.76 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DSMN1; SMN2

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