SCHEMBL7658933

SCHEMBL7658933

COc1ccc2c(c1)c(-c1nc3cc4ccccc4cc3n(OC(C)=O)c1=O)cn2CCCN

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.46
PDE4D Q08499 2/20 0.46
GSK3B P49841 8/20 0.42
QPCT Q16769 6/20 0.42
PRKD1 Q15139 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CAMK2D Q13557 2/20 0.40
CNR2 P34972 2/20 0.40
KDR P35968 1/20 0.39
HTR6 P50406 3/20 0.39
RXRA P19793 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
SCHEMBL7663787 0.90 PDE4B (0.42) PDE4BPDE4DGSK3BQPCTHTR6
SCHEMBL8362797 0.90 PDE4B (0.43) PDE4BPDE4DGSK3BQPCTCAMK2D
SCHEMBL7658242 0.90 MAOB (0.38) PDE4BPDE4DCAMK2DKDR
SCHEMBL7664768 0.89 CAMK2D (0.46) GSK3BCAMK2DCNR2KDR
SCHEMBL7662560 0.89 PDE4B (0.40) PDE4BPDE4DGSK3BQPCTHTR6
SCHEMBL7662842 0.89 PDE4B (0.40) PDE4BPDE4DGSK3BQPCTPRKD1
SCHEMBL7659720 0.87 CAMK2D (0.36) PDE4BPDE4DGSK3BQPCTTDP1
SCHEMBL7657341 0.86 CAMK2D (0.36) PDE4BPDE4DGSK3BQPCTCAMK2D
SCHEMBL7659626 0.86 CAMK2D (0.43) GSK3BCAMK2DKDR
SCHEMBL8516344 0.85 CAMK2D (0.40) PDE4BPDE4DGSK3BQPCTCAMK2D

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 3 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 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