SCHEMBL7660686

SCHEMBL7660686

CC(=O)On1ncc2cc3[nH]c(=O)c(-c4cn(CCCN)c5ccc(N(Cc6ccccc6)Cc6ccccc6)cc45)nc3cc21

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 12/20 0.33
BDKRB2 P30411 2/20 0.33
RPS6KB1 P23443 1/20 0.32
TSSK1B Q9BXA7 2/20 0.31
KDR P35968 1/20 0.31
GSK3B P49841 1/20 0.31
PIM1 P11309 1/20 0.30

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
Acetic Acid SCHEMBL7657331 0.87 CAMK2D (0.38) CAMK2DBDKRB2RPS6KB1TSSK1BKDR
SCHEMBL7657220 0.87 CAMK2D (0.42) CAMK2DRPS6KB1KDRGSK3BPIM1
SCHEMBL7655905 0.87 EGLN1 (0.39) CAMK2DKDR
SCHEMBL7658179 0.87 CAMK2D (0.33) CAMK2DBDKRB2RPS6KB1TSSK1BPIM1
SCHEMBL7664757 0.86 CAMK2D (0.38) CAMK2DGSK3B
SCHEMBL7656952 0.86 BDKRB2 (0.34) CAMK2DBDKRB2RPS6KB1TSSK1BKDR
Acetic Acid SCHEMBL7660674 0.86 CAMK2D (0.35) CAMK2DBDKRB2RPS6KB1TSSK1BGSK3B
Acetic Acid SCHEMBL7656941 0.85 BDKRB2 (0.35) CAMK2DBDKRB2RPS6KB1TSSK1BPIM1
SCHEMBL7664653 0.85 PDE4B (0.38) KDRGSK3B
Acetic Acid SCHEMBL8365280 0.84 CAMK2D (0.39) CAMK2DBDKRB2RPS6KB1

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 1 patent. 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