SCHEMBL5083648

SCHEMBL5083648

CCNc1ncnc2c1ncn2C(CC)(COC(c1ccccc1)(c1ccccc1)c1ccccc1)OCP(=O)(O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DNPH1 O43598 2/20 0.37
NT5E P21589 1/20 0.36
CDK1 P06493 2/20 0.35
P2RY12 Q9H244 5/20 0.35
TMIGD3 P0DMS9 4/20 0.35
ADORA2A P29274 4/20 0.35
ADORA1 P30542 4/20 0.35
ADORA2B P29275 1/20 0.35
CCNB2 O95067 1/20 0.34
CCNB1 P14635 1/20 0.34
CDK2 P24941 1/20 0.34
CCNB3 Q8WWL7 1/20 0.34
P2RX3 P56373 1/20 0.34
P2RX2 Q9UBL9 1/20 0.34
TYMP P19971 1/20 0.33
P2RY1 P47900 1/20 0.33

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
SCHEMBL5086082 0.91 NPC1 (0.36) DNPH1NT5ECDK1P2RY12TMIGD3
SCHEMBL5086064 0.88 TAS1R3 (0.38) NT5EADORA2AADORA1ADORA2B
SCHEMBL5083566 0.87 TAS1R3 (0.42) NT5EADORA2AADORA1ADORA2B
SCHEMBL5083644 0.87 ADORA1 (0.41) NT5EADORA2AADORA1ADORA2B
SCHEMBL5086004 0.85 KDM4E (0.36) NT5EADORA2ATYMP
SCHEMBL5080069 0.81 CDK1 (0.40) CDK1TMIGD3ADORA2AADORA1ADORA2B
SCHEMBL5083667 0.77 P2RY1 (0.33) DNPH1P2RY12ADORA1CDK2P2RX3
SCHEMBL5083620 0.75 CCNB2 (0.39) DNPH1NT5ECDK1TMIGD3ADORA2A
SCHEMBL5080090 0.72 RAB9A (0.40) CDK1TMIGD3ADORA2AADORA1ADORA2B
SCHEMBL5083000 0.69 ADORA1 (0.41) ADORA2AADORA1ADORA2B

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 566/4885NT5E 1175/4885CDK1 704/4885

“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.