SCHEMBL5082979

SCHEMBL5082979

CC(C)OC(=O)OC(OC(=O)OC(C)C)OP(=O)(O)COCCC(CO)n1cnc2c(Nc3ccccc3)ncnc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNPH1 O43598 1/20 0.37
CDK1 P06493 4/20 0.37
CCNB2 O95067 3/20 0.37
CCNB1 P14635 3/20 0.37
CCNB3 Q8WWL7 3/20 0.37
P2RX3 P56373 1/20 0.35
P2RX4 Q99571 1/20 0.35
P2RX2 Q9UBL9 1/20 0.35
DNMT3B Q9UBC3 1/20 0.35
CDK2 P24941 2/20 0.35
CCNE2 O96020 1/20 0.34
CCNE1 P24864 1/20 0.34
FGFR1 P11362 1/20 0.34
HDAC1 Q13547 3/20 0.34
HDAC2 Q92769 3/20 0.34
LMNA P02545 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34
PMP22 Q01453 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL5083025 0.86 POLB (0.38) CDK2FGFR1PMP22CYP1A2NFKB1
SCHEMBL5082361 0.85 FGFR1 (0.47) FGFR1
SCHEMBL5086107 0.84 FGFR1 (0.37) FGFR1PMP22CYP1A2NFKB1THPO
SCHEMBL5082457 0.82 FGFR1 (0.38) FGFR1CYP1A2
SCHEMBL5082976 0.78 FAP (0.43) FGFR1
SCHEMBL5080065 0.78 FGFR1 (0.44) FGFR1
SCHEMBL5083016 0.74 CDK5 (0.33) CDK1CCNB2CCNB1CCNB3CDK2
SCHEMBL5086060 0.74 SERPINA3 (0.32) CDK1CCNB2CCNB1CCNB3CDK5
SCHEMBL5086381 0.73 DNPH1 (0.40) DNPH1CDK1CCNB2CCNB1CCNB3
SCHEMBL14175399 0.71 P2RY1 (0.43) CDK1CCNB2CCNB1CCNB3CDK2

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 DNPH1 566/4885CDK1 704/4885CCNB2 428/4885

“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.