SCHEMBL1506529

SCHEMBL1506529

COC(C)(OP(=O)(O)O)[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)[C@H](O)[C@@H]1O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.56
▸ TGM2 P21980 1/20 0.53
▸ HINT1 P49773 3/20 0.52
▸ IMPDH2 P12268 4/20 0.51
▸ IMPDH1 P20839 1/20 0.51
▸ KRAS P01116 4/20 0.50
▸ FUT5 Q11128 1/20 0.49
▸ STING1 Q86WV6 2/20 0.49
▸ PDE3B Q13370 1/20 0.49
▸ PDE3A Q14432 1/20 0.49
▸ GSK3A P49840 2/20 0.47
▸ RPS6KA3 P51812 2/20 0.47
▸ MAPK14 Q16539 2/20 0.47
▸ TAS1R3 Q7RTX0 1/20 0.47
▸ TAS1R1 Q7RTX1 1/20 0.47

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
SCHEMBL16496063 0.93 TGM2 (0.54) NT5ETGM2HINT1IMPDH2IMPDH1
SCHEMBL237754 0.86 HINT1 (0.58) NT5ETGM2HINT1KRASSTING1
SCHEMBL18841403 0.79 NT5E (0.64) NT5ETGM2HINT1IMPDH2IMPDH1
SCHEMBL1120568 0.79 HINT1 (0.59) NT5ETGM2HINT1KRASSTING1
Phosphoric Acid SCHEMBL25402859 0.79 NT5E (0.63) NT5ETGM2HINT1IMPDH2IMPDH1
SCHEMBL16555277 0.79 HINT1 (0.55) NT5ETGM2HINT1KRASSTING1
Phosphoric Acid SCHEMBL1299515 0.79 NT5E (0.63) NT5ETGM2HINT1IMPDH2IMPDH1
SCHEMBL1299520 0.79 NT5E (0.58) NT5ETGM2HINT1IMPDH2IMPDH1
SCHEMBL1299533 0.79 NT5E (0.58) NT5ETGM2HINT1IMPDH2IMPDH1
SCHEMBL19183426 0.78 NT5E (0.57) NT5ETGM2HINT1IMPDH2IMPDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2297175-A2 MRNA CAP ANALOGS Uniwersytet Warszawski (PL) 2011-03-23 — — EP disclosed
WO-2009149253-A2 MRNA CAP ANALOGS UNIWERSYTET WARSZAWSKI (PL) 2009-12-10 — — WO disclosed
EP-1575974-B1 MODIFIED GUANOSINES HAVING FLAVOURING ACTIVITY FRUCTAMINE SPA (IT) 2008-03-19 — — EP disclosed
US-20050288499-A1 Modified guanosines having flavouring activity KERRY GROUP SERVICES INTERNATIONAL LIMITED (IE) 2005-12-29 — — 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-20050288499-A1 Modified guanosines having flavouring activity GMPS, RNMT, CGAS NT5E 439/4885TGM2 361/4885HINT1 299/4885

“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.

Send feedback