SCHEMBL8334162

SCHEMBL8334162

CC(C)c1[nH]c(=O)c(-c2csc(-c3ccncc3)n2)cc1C(N)=O

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 19/20 0.74
CDK5R1 Q15078 19/20 0.74
CDC7 O00311 1/20 0.56

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
SCHEMBL5901324 0.90 CDK5 (0.75) CDK5CDK5R1
SCHEMBL5902368 0.88 CDK5 (0.80) CDK5CDK5R1
SCHEMBL8333507 0.88 CDK5 (0.71) CDK5CDK5R1
SCHEMBL8333336 0.88 CDK5 (0.71) CDK5CDK5R1
SCHEMBL8326772 0.85 CDK5 (0.70) CDK5CDK5R1
SCHEMBL5901554 0.85 CDK5 (1.00) CDK5CDK5R1
SCHEMBL5902159 0.84 CDK5 (0.84) CDK5CDK5R1
SCHEMBL8333069 0.84 CDK5 (0.69) CDK5CDK5R1
SCHEMBL5901934 0.83 CDK5 (0.66) CDK5CDK5R1
SCHEMBL5902220 0.83 CDK5 (0.82) CDK5CDK5R1

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
WO-2004060890-A1 2-OXOPYRIDIN-3-YL THIA (DI) AZOLE DERIVATES FOR USE IN THE TREATMENT OF CELL PROLIFERATION AND APOPTOSIS RELATED DISEASES AMGEN INC. (US) 2004-07-22 WO disclosed