SCHEMBL1890986

SCHEMBL1890986

CN[C@@H](Cc1c[nH]cn1)C(=O)NP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)[C@H](O)[C@@H]1O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.61
NT5E P21589 1/20 0.58
KRAS P01116 10/20 0.55
HINT1 P49773 4/20 0.53
TAS1R3 Q7RTX0 1/20 0.52
TAS1R1 Q7RTX1 1/20 0.52
GSK3A P49840 1/20 0.52
RPS6KA3 P51812 1/20 0.52
MAPK14 Q16539 1/20 0.52
FUT5 Q11128 1/20 0.52

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
SCHEMBL1890617 0.91 TGM2 (0.63) TGM2NT5EKRASHINT1TAS1R3
SCHEMBL1892944 0.88 POLB (0.58) TGM2NT5EKRASTAS1R3TAS1R1
SCHEMBL1891451 0.88 TGM2 (0.63) TGM2NT5EKRASHINT1TAS1R3
SCHEMBL1893133 0.87 P2RY1 (0.59) NT5ETAS1R3TAS1R1
SCHEMBL1895367 0.83 P2RY2 (0.50)
SCHEMBL1894008 0.82 DNPH1 (0.44) NT5E
SCHEMBL1893832 0.81 P2RY6 (0.53)
SCHEMBL1891833 0.81 TGM2 (0.66) TGM2NT5EKRASHINT1TAS1R3
SCHEMBL1894736 0.80 TGM2 (0.87) TGM2NT5EKRASHINT1TAS1R3
SCHEMBL1889076 0.79 POLB (0.60) TGM2NT5EKRASTAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242087-B2 Phosphate modified nucleosides useful as substrates for polymerases and as antiviral agents K.U.LEUVEN RESEARCH & DEVELOPMENT (BE) 2012-08-14 US disclosed
US-20110112046-A9 PHOSPHATE MODIFIED NUCLEOSIDES USEFUL AS SUBSTRATES FOR POLYMERASES AND AS ANTIVIRAL AGENTS K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2011-05-12 US disclosed
US-20100093656-A1 PHOSPHATE MODIFIED NUCLEOSIDES USEFUL AS SUBSTRATES FOR POLYMERASES AND AS ANTIVIRAL AGENTS K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2010-04-15 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 (2 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-20110112046-A9 PHOSPHATE MODIFIED NUCLEOSIDES USEFUL AS SUBSTRATES FOR POLYMERASES AND AS ANTIVIRAL AGENTS MTAP, POLRMT, PNP TGM2 2951/4885NT5E 50/4885KRAS 4739/4885
US-20100093656-A1 PHOSPHATE MODIFIED NUCLEOSIDES USEFUL AS SUBSTRATES FOR POLYMERASES AND AS ANTIVIRAL AGENTS MTAP, POLRMT, PNP TGM2 2951/4885NT5E 50/4885KRAS 4739/4885

“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.