SCHEMBL22920150

SCHEMBL22920150

NCc1cn(C2CCCCC2)cn1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 16/20 0.54
CPB1 P15086 2/20 0.39
CDK5 Q00535 2/20 0.37
CDK5R1 Q15078 2/20 0.37

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
SCHEMBL17615544 0.82 CPB2 (0.51) CPB2CPB1CDK5CDK5R1
SCHEMBL26246698 0.82 CPB2 (0.48) CPB2CPB1CDK5CDK5R1
SCHEMBL22747428 0.76 CPB2 (0.43) CPB2CDK5CDK5R1
SCHEMBL20707185 0.76 CPB2 (0.46) CPB2CPB1CDK5CDK5R1
SCHEMBL25199851 0.76 CPB1 (0.44) CPB2CPB1CDK5CDK5R1
SCHEMBL5470662 0.75 CPB2 (0.54) CPB2CPB1CDK5CDK5R1
SCHEMBL19141821 0.74 CPB2 (0.54) CPB2CPB1CDK5CDK5R1
SCHEMBL20080534 0.74 CPB2 (0.54) CPB2CPB1CDK5CDK5R1
SCHEMBL19141762 0.74 CPB2 (0.54) CPB2CPB1CDK5CDK5R1
Hydrochloric Acid SCHEMBL23389336 0.74 CPB1 (0.43) CPB2CPB1CDK5CDK5R1

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-2021016333-A1 ARYL SULFONAMIDES AS SMALL MOLECULE STAT3 INHIBITORS UNIVERSITY OF HAWAII (US) 2021-01-28 WO disclosed