SCHEMBL21782407

SCHEMBL21782407

CNc1ncnc2c1ncn2C(O)C(O)C(CCOOC)OC

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 5/20 0.42
CDK1 P06493 5/20 0.42
CCNB1 P14635 5/20 0.42
CCNB3 Q8WWL7 5/20 0.42
YTHDC1 Q96MU7 2/20 0.40
P2RY1 P47900 2/20 0.39
ADORA3 P0DMS8 8/20 0.38
ADORA1 P30542 5/20 0.38
AHCY P23526 2/20 0.36

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
SCHEMBL21082387 0.86 CCNB2 (0.34) CCNB2CDK1CCNB1CCNB3ADORA1
SCHEMBL21782435 0.85 CDK1 (0.44) CDK1CCNB1ADORA3ADORA1
SCHEMBL21082621 0.82 CCNB2 (0.41) CCNB2CDK1CCNB1CCNB3ADORA1
SCHEMBL21082477 0.77
SCHEMBL21082443 0.77 HPRT1 (0.42)
SCHEMBL24063585 0.72
SCHEMBL21082493 0.72 PRMT5 (0.37)
SCHEMBL21782406 0.71 ADORA2A (0.38) ADORA3ADORA1
SCHEMBL27430176 0.70 CDK1 (0.63) CCNB2CDK1CCNB1CCNB3ADORA3
SCHEMBL24220583 0.69 ADORA1 (0.51) ADORA3ADORA1

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-3492109-B1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNATX INC (US) 2020-03-04 EP disclosed