SCHEMBL10438293

SCHEMBL10438293

CCCCCC(N)Nc1nc(N)c2nc[nH]c2n1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 1/20 0.35
CDK1 P06493 3/20 0.33
CCNB1 P14635 3/20 0.33
CCNA2 P20248 2/20 0.33
CDK2 P24941 2/20 0.33
CCNA1 P78396 2/20 0.33
TLR8 Q9NR97 1/20 0.32
PIN1 Q13526 1/20 0.31

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
SCHEMBL6036797 0.79 CDK1 (0.34) POLA1CDK1CCNB1CCNA2CDK2
SCHEMBL24207973 0.79 KCNH3 (0.41) POLA1CDK1CDK2TLR8
SCHEMBL16146635 0.77 XDH (0.42) CDK1CDK2
SCHEMBL516302 0.75 ADORA2A (0.39) CDK1CCNB1
SCHEMBL16146951 0.74 ADORA2A (0.41) POLA1CDK1CDK2
SCHEMBL18546888 0.73 CDK1 (0.34) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL10047120 0.73 L3MBTL1 (0.38) POLA1CDK1CCNB1CCNA2CDK2
SCHEMBL2306213 0.73 CDK1 (0.32) POLA1CDK1CCNB1CCNA2CDK2
SCHEMBL4551801 0.72 ADORA2A (0.44) POLA1CDK1CCNB1CCNA2CDK2
SCHEMBL23133115 0.71 CDK1 (0.43) CDK1CCNB1CCNA2CDK2CCNA1

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
EP-0399330-A1 Modified phosphoramidite process for preparing modified nucleic acids Roche Diagnostics GmbH (DE) 1990-11-28 EP disclosed