SCHEMBL7379692

SCHEMBL7379692

COc1ccc(Cn2cncc3nc(C(C)C)nc2-3)cc1OC1CCC(O)C1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 17/20 0.41
PDE4B Q07343 16/20 0.41
PDE4C Q08493 16/20 0.41
PDE4D Q08499 16/20 0.41
QPCT Q16769 1/20 0.36
FPR2 P25090 1/20 0.35
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL7241642 0.89 PDE4A (0.50) PDE4APDE4BPDE4CPDE4DQPCT
SCHEMBL7377329 0.86 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DQPCT
SCHEMBL7212615 0.83 PDE4A (0.43) PDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL7211531 0.82 PDE4A (0.42) PDE4APDE4BPDE4CPDE4D
SCHEMBL7209404 0.80 PDE4A (0.42) PDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL7205722 0.80 PDE4A (0.42) PDE4APDE4BPDE4CPDE4D
SCHEMBL7740531 0.79 PDE4A (0.35) PDE4APDE4BPDE4CPDE4D
SCHEMBL28139968 0.79 QPCT (0.46) PDE4APDE4BPDE4CPDE4DQPCT
SCHEMBL6418035 0.74 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DQPCT
SCHEMBL6155742 0.73 PDE4A (0.53) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1169321-A4 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY EURO CELTIQUE SA (LU) 2002-10-30 EP disclosed
US-6413975-B1 DISEASES WITH HIGH LEVELS OF INFLAMMATORY CYTOKINES; ASTHMA; ALLERGIES; INFLAMMATION; DEPRESSION; ALZHEIMER'S DISEASE; VASCULAR AND MULTI-IN-FARCT DEMENTIA EURO-CELTIQUE, S.A. (LU) 2002-07-02 US disclosed
EP-1169321-A2 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY Euro-Celtique S.A. (LU) 2002-01-09 EP disclosed
US-6319928-B1 ASTHMA, ALLERGIES, INFLAMMATION,DEPRESSION, DEMENTIA, ALZHEIMER'S DISEASE, VASCULAR AND MULTI-IN-FARCT DEMENTIA AND DISEASE CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS TREATMENT; EFFICIENCY AND SELECTIVITY EURO-CELTIQUE, S.A. (LU) 2001-11-20 US disclosed
US-6294541-B1 ENZYME INHIBITORS USING PURINE COMPOUNDS AS ANTIHISTAMINES EURO-CELTIQUE S.A. (LU) 2001-09-25 US disclosed
WO-2000059449-A2 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY EURO-CELTIQUE S.A. (LU) 2000-10-12 WO disclosed