SCHEMBL7278945

SCHEMBL7278945

COc1cc2cc(COC(C)=O)c(COC(C)=O)c(-c3ccc(=O)n(C)c3)c2cc1OC

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 15/20 0.48
PDE3A Q14432 15/20 0.48
PDE4A P27815 14/20 0.48
PDE4B Q07343 14/20 0.48
PDE4C Q08493 14/20 0.48
PDE4D Q08499 14/20 0.48
PDE5A O76074 12/20 0.44
PDE1A P54750 11/20 0.44
PDE1B Q01064 11/20 0.44
PDE1C Q14123 11/20 0.44
BRD4 O60885 3/20 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
SCHEMBL7285560 0.86 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7285984 0.82 PDE4A (0.67) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7286791 0.80 PDE3B (0.47) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7286296 0.80 PDE3B (0.55) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7286974 0.79 PDE4A (0.72) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7279466 0.78 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7276791 0.78 PDE3B (0.51) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL3880895 0.78 PDE3B (0.46) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7286046 0.78 PDE4A (0.55) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7288680 0.77 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C

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-0557016-B1 Naphthalene derivatives, processes for preparing the same, and synthetic intermediates therefor TANABE SEIYAKU CO (JP) 1996-06-19 EP disclosed
US-5342941-A Bronchodilating agents TANABE SEIYAKU CO., LTD. (JP) 1994-08-30 US disclosed
EP-0557016-A1 Naphthalene derivatives, processes for preparing the same, and synthetic intermediates therefor TANABE SEIYAKU CO., LTD. (JP) 1993-08-25 EP disclosed