SCHEMBL7733932

SCHEMBL7733932

COc1ccc(Cc2nc3cc(Cl)cc(CC(=O)O)c3o2)cc1OC1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 12/20 0.42
PDE4B Q07343 10/20 0.41
PDE4C Q08493 8/20 0.41
PDE4D Q08499 8/20 0.41
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
STAT3 P40763 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL7725341 0.93 PDE4B (0.40) PDE4APDE4BPDE4CPDE4DMEN1
Carbamic Acid SCHEMBL7735372 0.89 PDE4A (0.40) PDE4APDE4BPDE4CPDE4D
SCHEMBL7733871 0.88 RECQL (0.41) PDE4APDE4BPDE4CPDE4D
Carbamic Acid SCHEMBL7735701 0.87 PDE4A (0.39) PDE4APDE4BPDE4CPDE4D
Carbamic Acid SCHEMBL7735694 0.87 PDE4A (0.39) PDE4APDE4BPDE4CPDE4D
SCHEMBL7733965 0.87 PDE4B (0.41) PDE4APDE4BPDE4CPDE4D
SCHEMBL7735218 0.87 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL7735374 0.87 PDE4B (0.39) PDE4APDE4BPDE4CPDE4DMEN1
SCHEMBL7733891 0.86 PDE4A (0.40) PDE4APDE4BPDE4CPDE4D
SCHEMBL7724881 0.85 PDE4A (0.40) PDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6372770-B1 TREATING A MAMMAL SUFFERING FROM A DISEASE STATE SELECTED FROM THE GROUP CONSISTING OF ASTHMA, ALLERGIES, INFLAMMATION, DEPRESSION, DEMENTIA, ATOPIC DISEASES, RHINITIS AND DISEASE STATES ASSOCIATED WITH ABNORMALLY HIGH PHYSIOLOGICAL LEVELS OF EURO-CELTIQUE, S.A. 2002-04-16 US claimed
US-6372770-B1 TREATING A MAMMAL SUFFERING FROM A DISEASE STATE SELECTED FROM THE GROUP CONSISTING OF ASTHMA, ALLERGIES, INFLAMMATION, DEPRESSION, DEMENTIA, ATOPIC DISEASES, RHINITIS AND DISEASE STATES ASSOCIATED WITH ABNORMALLY HIGH PHYSIOLOGICAL LEVELS OF EURO-CELTIQUE, S.A. 2002-04-16 US disclosed
EP-0785927-A4 NOVEL BENZOXAZOLES EURO CELTIQUE SA (LU) 1997-12-29 EP disclosed
EP-0785927-A1 NOVEL BENZOXAZOLES Euroceltique S.A. (LU) 1997-07-30 EP disclosed
WO-1996011917-A1 NOVEL BENZOXAZOLES EURO-CELTIQUE, S.A. (LU) 1996-04-25 WO disclosed