SCHEMBL30369906

SCHEMBL30369906

N#Cc1ccc2nccc(NCCc3ccc4cc(C(=O)O)ccc4c3)c2c1

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 17/20 0.80
CCNC P24863 16/20 0.80
CDK19 Q9BWU1 5/20 0.80
MAP4K2 Q12851 2/20 0.72
HASPIN Q8TF76 2/20 0.72
CDK1 P06493 4/20 0.53

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
SCHEMBL25176626 1.00 CDK8 (0.80) CDK8CCNCCDK19MAP4K2HASPIN
SCHEMBL25414868 0.90 CDK8 (0.79) CDK8CCNCCDK19MAP4K2HASPIN
SCHEMBL30369499 0.90 CDK8 (0.79) CDK8CCNCCDK19MAP4K2HASPIN
SCHEMBL21750402 0.89 CDK8 (1.00) CDK8CCNCCDK19MAP4K2HASPIN
SCHEMBL21750435 0.85 CDK8 (1.00) CDK8CCNCCDK19MAP4K2HASPIN
SCHEMBL29472163 0.85 CDK8 (1.00) CDK8CCNCCDK19MAP4K2HASPIN
SCHEMBL23780572 0.84 CDK8 (1.00) CDK8CCNCCDK19MAP4K2HASPIN
SCHEMBL21750429 0.84 CDK8 (1.00) CDK8CCNCCDK19MAP4K2HASPIN
SCHEMBL23780576 0.84 CDK8 (1.00) CDK8CCNCCDK19MAP4K2HASPIN
SCHEMBL29472137 0.84 CDK8 (1.00) CDK8CCNCCDK19MAP4K2HASPIN

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-2023081452-A1 SMALL-MOLECULE DEGRADERS OF CDK8 AND CDK19 UNIVERSITY OF SOUTH CAROLINA (US) 2023-05-11 WO disclosed