SCHEMBL1834044

SCHEMBL1834044

CC1(C)O[C@@H]2[C@H](O1)[C@@H](N)C[C@H]2O

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
ACHE P22303 1/20 0.33
MGAM2 Q2M2H8 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
SCHEMBL15698958 1.00 MGAM (0.33) MGAMCA1CA2GAASI
SCHEMBL14709158 1.00 MGAM (0.33) MGAMCA1CA2GAASI
SCHEMBL28489991 1.00 MGAM (0.33) MGAMCA1CA2GAASI
SCHEMBL12280418 1.00 MGAM (0.33) MGAMCA1CA2GAASI
SCHEMBL2362689 1.00 MGAM (0.33) MGAMCA1CA2GAASI
SCHEMBL15859653 1.00 MGAM (0.33) MGAMCA1CA2GAASI
SCHEMBL14709006 1.00 MGAM (0.33) MGAMCA1CA2GAASI
SCHEMBL1509195 1.00 MGAM (0.33) MGAMCA1CA2GAASI
SCHEMBL1255498 1.00 MGAM (0.33) MGAMCA1CA2GAASI
SCHEMBL12910763 1.00 MGAM (0.33) MGAMCA1CA2GAASI

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE46276-E1 Triazolo(4,5-D)pyrimidine compounds ASTRAZENECA UK LIMITED (GB) 2017-01-17 US disclosed
EP-2707363-B1 A PROCESS FOR THE PREPARATION OF BENZYL [(3AS,4R,6S,6AR)-6-HYDROXY-2,2- DIMETHYLTETRAHYDRO-3AH-CYCLOPENTA[D][1,3]DIOXOL]-4-YL]CARBAMATE AND INTERMEDIATES IN THE PROCESS ASTRAZENECA AB (SE) 2015-10-21 EP disclosed
US-9079873-B2 Process for the preparation of benzyl [(3aS,4R,6S,6aR)-6-hydroxy-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol]-4-yl]carbamate and intermediates in the process ASTRAZENECA AB (SE) 2015-07-14 US disclosed
US-20150152111-A1 TRISUBSTITUTED TRIAZOLOPYRIMIDINES FOR USE IN PLATELET AGGREGATION INHIBITION ASTRAZENECA UK LIMITED (GB) 2015-06-04 US disclosed
US-20140296258-A1 TRISUBSTITUTED TRIAZOLOPYRIMIDINES FOR USE IN PLATELET AGGREGATION INHIBITON ASTRAZENECA UK LIMITED (GB) 2014-10-02 US disclosed
US-20140135509-A1 Process for the Preparation of Benzyl [(3aS,4R,6S,6aR)-6-hydroxy-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol]-4-yl]carbamate and Intermediates in the Process ASTRAZENECA AB (SE) 2014-05-15 US disclosed
US-20130109702-A1 TRISUBSTITUTED TRIAZOLOPYRIMIDINES FOR USE IN PLATELET AGGREGATION INHIBITION ASTRAZENECA AB (GB) 2013-05-02 US disclosed
US-8273879-B2 Triazolo pyrimidine compounds ASTRAZENECA AB (SE) 2012-09-25 US disclosed
US-20110218330-A1 Novel triazolo pyrimidine compounds ASTRAZENECA AB (SE) 2011-09-08 US disclosed
EP-1386917-B1 Intermediates for the preparation of certain triazolopyrimidines as P2T antagonists ASTRAZENECA AB (SE) 2011-06-22 EP disclosed
US-7250419-B2 Trisubstituted triazolopyrimidines for use in platelet aggregation inhibition ASTRAZENECA AB (SE) 2007-07-31 US disclosed
US-7067663-B2 Triazolo pyrimidine compounds ASTRAZENECA AB (SE) 2006-06-27 US disclosed
US-20060041132-A1 Novel triazolo pyrimidine compounds ASTRAZENECA AB (SE) 2006-02-23 US disclosed
EP-1135391-B1 NOVEL TRIAZOLO(4,5-D)PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2004-03-17 EP disclosed
EP-1386921-A1 Intermediates AstraZeneca AB (SE) 2004-02-04 EP disclosed
EP-1386917-A1 Intermediates AstraZeneca AB (SE) 2004-02-04 EP disclosed
US-20030148888-A1 Novel triazolo pyrimidine compounds ASTRAZENECA AB (SE) 2003-08-07 US disclosed
US-6525060-B1 P2T (P2YADP or P2TAC) receptor antagonists; anticoagulant, antithrombotic ASTRAZENECA UK LIMITED (GB) 2003-02-25 US disclosed
EP-1135391-A1 NOVEL TRIAZOLO(4,5-D)PYRIMIDINE COMPOUNDS AstraZeneca AB (SE) 2001-09-26 EP disclosed
WO-2000034283-A1 NOVEL TRIAZOLO(4,5-D)PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2000-06-15 WO 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 (7 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-20030148888-A1 Novel triazolo pyrimidine compounds TYMS, TYMP, DPYD MGAM 4795/4885CA1 4866/4885CA2 4833/4885
US-20150152111-A1 TRISUBSTITUTED TRIAZOLOPYRIMIDINES FOR USE IN PLATELET AGGREGATION INHIBITION THPO, PF4, P2RY4 MGAM 4597/4885CA1 4876/4885CA2 3132/4885
US-20060041132-A1 Novel triazolo pyrimidine compounds TYMS, TYMP, DPYD MGAM 4795/4885CA1 4866/4885CA2 4833/4885
US-20140135509-A1 Process for the Preparation of Benzyl [(3aS,4R,6S,6aR)-6-hydroxy-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol]-4-yl]carbamate and Intermediates in the Process CYP4X1, CYP4B1, CBR3 MGAM 2099/4885CA1 1334/4885CA2 832/4885
US-20140296258-A1 TRISUBSTITUTED TRIAZOLOPYRIMIDINES FOR USE IN PLATELET AGGREGATION INHIBITON GP6, THPO, P2RY6 MGAM 3717/4885CA1 4870/4885CA2 2565/4885
US-20130109702-A1 TRISUBSTITUTED TRIAZOLOPYRIMIDINES FOR USE IN PLATELET AGGREGATION INHIBITION THPO, PF4, P2RY4 MGAM 4597/4885CA1 4876/4885CA2 3132/4885
US-20110218330-A1 Novel triazolo pyrimidine compounds TYMS, TYMP, DPYD MGAM 4795/4885CA1 4866/4885CA2 4833/4885

“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.