SCHEMBL5082974

SCHEMBL5082974

CONc1nc(C(c2ccccc2)(c2ccccc2)c2ccccc2)nc2c1ncn2C(CF)CCOCP(=O)(OC(C)C)OC(C)C

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCNE2 O96020 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CDK1 P06493 13/20 0.32
CCNB1 P14635 7/20 0.32
CDK5 Q00535 9/20 0.31
CDK5R1 Q15078 6/20 0.31
CCNB2 O95067 4/20 0.31
CCNB3 Q8WWL7 4/20 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
SCHEMBL5086364 0.92 CCNE1 (0.32) CCNE2CCNE1CDK2KDM4ENPC1
SCHEMBL5082395 0.92 CDK1 (0.35) CCNE2CCNE1CDK2CDK1CCNB1
SCHEMBL5082380 0.90 HPRT1 (0.38) CCNE2CCNE1CDK2KDM4ENPC1
SCHEMBL5086347 0.88 CCNE2 (0.32) CCNE2CCNE1CDK2CDK1CCNB1
SCHEMBL5086060 0.86 SERPINA3 (0.32) CDK1CCNB1CDK5CDK5R1CCNB2
SCHEMBL5083005 0.85 CCNB2 (0.30) CDK1CCNB1CDK5CDK5R1CCNB2
SCHEMBL5080082 0.84 CCNB2 (0.31) CCNE2CCNE1CDK2CDK1CCNB1
SCHEMBL5082999 0.83 HPRT1 (0.40) CCNE2CCNE1CDK2CDK1CCNB1
SCHEMBL5080071 0.81 CDK1 (0.31) CDK1CCNB1
SCHEMBL5086113 0.81 HPRT1 (0.35) CCNE2CCNE1CDK2KDM4ENPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7388002-B2 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2008-06-17 US disclosed
US-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2006-06-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases POLR2H, NSUN2, POLR2E CCNE2 240/4885CCNE1 440/4885CDK2 339/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.