SCHEMBL7660922

SCHEMBL7660922

CC(=O)On1c(=O)c(-c2cn(Cc3cccc(CN)c3)c3ccccc23)nc2cc3c(cc21)CCC3

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 11/20 0.37
PDE4B Q07343 11/20 0.37
PDE4C Q08493 11/20 0.37
PDE4D Q08499 11/20 0.37
USP2 O75604 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
CASP1 P29466 2/20 0.37
CASP7 P55210 2/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
PDE3B Q13370 5/20 0.36
PDE3A Q14432 5/20 0.36
POLB P06746 1/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
CNR1 P21554 1/20 0.35

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
SCHEMBL7652540 0.98 PDE4A (0.37) PDE4APDE4BPDE4CPDE4DUSP2
SCHEMBL7664799 0.95 PDE4A (0.37) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7663917 0.94 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7657926 0.90 USP2 (0.41) PDE4APDE4BPDE4CPDE4DUSP2
SCHEMBL7664754 0.89 ACKR3 (0.34) PDE4APDE4BPDE4CPDE4DUSP2
SCHEMBL7655899 0.88 TP53 (0.39) POLB
SCHEMBL7656864 0.88 ACKR3 (0.34) PDE4APDE4BPDE4CPDE4DUSP2
SCHEMBL7662061 0.87 POLB (0.38) PDE4APDE4BPDE4CPDE4DUSP2
SCHEMBL7666306 0.87 USP2 (0.39) PDE4APDE4BPDE4CPDE4DUSP2
SCHEMBL7660574 0.87 TP53 (0.39) USP2POLB

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
US-6458792-B1 MEDICAMENT FOR THE TREATMENT OF INFLAMMATORY, IMMUNOLOGICAL, BRONCHOPULMONARY, CARDIOVASCULAR, ONCOLOGICAL OR CNS-DEGENERATIVE DISORDERS. ASTRAZENECA AB (SE) 2002-10-01 US claimed
EP-1071683-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2001-01-31 EP claimed
WO-1999046264-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 1999-09-16 WO claimed
US-6458792-B1 MEDICAMENT FOR THE TREATMENT OF INFLAMMATORY, IMMUNOLOGICAL, BRONCHOPULMONARY, CARDIOVASCULAR, ONCOLOGICAL OR CNS-DEGENERATIVE DISORDERS. ASTRAZENECA AB (SE) 2002-10-01 US disclosed
EP-1071683-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2001-01-31 EP disclosed
WO-1999046264-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 1999-09-16 WO disclosed