SCHEMBL7276796

SCHEMBL7276796

COc1cc(-c2c(COC(C)=O)c(COC(C)=O)cc3cc(OC)c(OC)cc23)ccn1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 18/20 0.57
PDE4B Q07343 18/20 0.57
PDE4C Q08493 18/20 0.57
PDE4D Q08499 18/20 0.57
PDE3B Q13370 17/20 0.57
PDE3A Q14432 17/20 0.57
PDE5A O76074 15/20 0.46
PDE1A P54750 14/20 0.46
PDE1B Q01064 14/20 0.46
PDE1C Q14123 14/20 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
SCHEMBL7286296 0.87 PDE3B (0.55) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7276791 0.85 PDE3B (0.51) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL3883045 0.81 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7285560 0.80 PDE3B (0.52) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7279466 0.79 PDE3B (0.49) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7746636 0.79 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7747600 0.79 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL3880895 0.79 PDE3B (0.46) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7286791 0.77 PDE3B (0.47) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7749441 0.77 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DPDE3B

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