SCHEMBL6545778

SCHEMBL6545778

N#C[C@]1(c2ccc(OC(F)F)c(OC(F)F)c2)CC[C@@H](C(=O)O)CC1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 0.63
PDE4A P27815 19/20 0.63
PDE4C Q08493 19/20 0.63
PDE4D Q08499 19/20 0.63

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
SCHEMBL6196511 1.00 PDE4B (0.63) PDE4BPDE4APDE4CPDE4D
SCHEMBL6196516 1.00 PDE4B (0.63) PDE4BPDE4APDE4CPDE4D
SCHEMBL6545792 0.91 PDE4B (0.56) PDE4BPDE4APDE4CPDE4D
SCHEMBL6546019 0.91 PDE4B (0.56) PDE4BPDE4APDE4CPDE4D
SCHEMBL6545789 0.91 PDE4B (0.56) PDE4BPDE4APDE4CPDE4D
SCHEMBL6197797 0.90 PDE4B (0.59) PDE4BPDE4APDE4CPDE4D
SCHEMBL6196613 0.90 PDE4B (0.59) PDE4BPDE4APDE4CPDE4D
SCHEMBL6196611 0.90 PDE4B (0.59) PDE4BPDE4APDE4CPDE4D
SCHEMBL7451202 0.89 PDE4B (0.58) PDE4BPDE4APDE4CPDE4D
SCHEMBL6196833 0.87 PDE4B (0.54) PDE4BPDE4APDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1051172-B1 METHOD FOR TREATING COPD SMITHKLINE BEECHAM CORP (US) 2004-12-22 EP claimed
EP-0919544-B1 Compounds useful for treating allergic and inflammatory diseases SMITHKLINE BEECHAM CORP (US) 2003-05-14 EP claimed
EP-1420011-A1 Compounds usefulfor treating allergic and inflammatory diseases SMITHKLINE BEECHAM CORPORATION (US) 2004-05-19 EP disclosed
EP-1380571-A1 Compounds useful for treating allergic and inflammatory diseases SMITHKLINE BEECHAM CORPORATION (US) 2004-01-14 EP disclosed
EP-0919544-B1 Compounds useful for treating allergic and inflammatory diseases SMITHKLINE BEECHAM CORP (US) 2003-05-14 EP disclosed
EP-0633776-B1 COMPOUNDS USEFUL FOR TREATING ALLERGIC AND INFLAMMATORY DISEASES SMITHKLINE BEECHAM CORP (US) 2001-05-09 EP disclosed
EP-0919544-A1 Compounds useful for treating allergic and inflammatory diseases SMITHKLINE BEECHAM CORPORATION (US) 1999-06-02 EP disclosed
US-5643946-A Compounds useful for treating allergic and inflammatory diseases SMITHKLINE BEECHAM CORPORATION (US) 1997-07-01 US disclosed
US-5614540-A Compounds useful for treating allergic and inflammatory diseases SMITHKLINE BEECHAM CORPORATION (US) 1997-03-25 US disclosed
US-5602157-A Compounds useful for treating allergic and inflammatory diseases SMITHKLINE BEECHAM CORPORATION (US) 1997-02-11 US disclosed
US-5552438-A Compounds useful for treating allergic and inflammatory diseases SMITHKLINE BEECHAM CORPORATION (US) 1996-09-03 US disclosed