SCHEMBL7742229

SCHEMBL7742229

COc1ccc(COC(C)(C)c2nc3c(N)ncn(Cc4ccc(OC)c(OC5CCCC5)c4)c-3n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.51
PDE4B Q07343 20/20 0.51
PDE4C Q08493 20/20 0.51
PDE4D Q08499 20/20 0.51

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
Hydrochloric Acid SCHEMBL7742150 0.99 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL7742225 0.94 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL7379736 0.94 PDE4A (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL7734205 0.94 PDE4A (0.48) PDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL7206477 0.93 PDE4A (0.48) PDE4APDE4BPDE4CPDE4D
SCHEMBL7379098 0.93 PDE4A (0.46) PDE4APDE4BPDE4CPDE4D
SCHEMBL7373829 0.93 PDE4A (0.48) PDE4APDE4BPDE4CPDE4D
SCHEMBL7742177 0.93 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL7734270 0.92 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL7738907 0.92 PDE4A (0.48) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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
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