SCHEMBL4481885

SCHEMBL4481885

Nc1nc(OCP(=O)(O)O)c2[nH]c(N)nc2n1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 11/20 0.39
▸ CDK2 P24941 11/20 0.39
▸ PNP P00491 4/20 0.39
▸ MGMT P16455 6/20 0.38
▸ CDK1 P06493 10/20 0.37
▸ CCNB1 P14635 10/20 0.37
▸ HPRT1 P00492 3/20 0.37
▸ CCNA1 P78396 8/20 0.35
▸ PIN1 Q13526 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
SCHEMBL10383666 0.76 CDK1 (0.47) CCNA2CDK2PNPMGMTCDK1
SCHEMBL5484380 0.71 PNP (0.44) CCNA2CDK2PNPCDK1CCNB1
SCHEMBL3300895 0.70 PIN1 (0.67) CCNA2CDK2PNPMGMTCDK1
SCHEMBL2242819 0.68 PNP (0.44) PNPHPRT1
SCHEMBL2242808 0.67 HPRT1 (0.34) CCNA2CDK2PNPCDK1CCNB1
SCHEMBL31676894 0.65 FBP1 (0.33) —
SCHEMBL6356987 0.64 PNP (0.54) PNP
SCHEMBL8933964 0.64 HPRT1 (0.35) HPRT1
SCHEMBL3396382 0.64 PNP (0.52) PNP
SCHEMBL3878333 0.63 FBP1 (0.36) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7517858-B1 Prodrugs of pharmaceuticals with improved bioavailability THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-04-14 — — US claimed
US-6599887-B2 Aids, herpes virus CHIMERIX, INC. 2003-07-29 — — US disclosed
US-6448392-B1 LIPID, ESPECIALLY PHOSPHOLIPID, DERIVATIVES OF MODIFIED ANTIVIRAL NUCLEOSIDE ANALOGUES CAN BE INTEGRATED INTO STRUCTURE OF LIPOSOMES, FORMING STABLE LIPOSOMAL COMPLEX, DELIVER GREATER AMOUNTS OF DRUGS TO CELLS WITH LESS TOXICITY CHIMERIX, INC. 2002-09-10 — — US disclosed
US-20010033862-A1 Methods of treating viral infections using antiviral liponucleotides HOSTETLER KARL Y (US) 2001-10-25 — — US disclosed
EP-0350287-B1 Lipid derivatives of antiviral nucleosides, liposomal incorporation and method of use CHIMERIX INC (US) 2000-09-27 — — EP disclosed
US-5223263-A Viricide complex; aids therapy VICAL, INC. (US) 1993-06-29 — — US disclosed
EP-0350287-A2 Lipid derivatives of antiviral nucleosides, liposomal incorporation and method of use NeXstar Pharmaceuticals, Inc. (US) 1990-01-10 — — EP 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-20010033862-A1 Methods of treating viral infections using antiviral liponucleotides PHOSPHO1, TK1, TYMP CCNA2 3938/4885CDK2 3427/4885PNP 7/4885

“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.

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