SCHEMBL505326

SCHEMBL505326

OC[C@H]1N[C@@H](c2[nH]nc3c(O)nc(O)nc23)[C@H](O)[C@@H]1O

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PNP P00491 10/20 0.56
MGAM O43451 5/20 0.40
AGL P35573 2/20 0.35
GAA P10253 2/20 0.35
GLA P06280 2/20 0.35
GBA2 Q9HCG7 1/20 0.35
GBA1 P04062 1/20 0.35
FUCA1 P04066 3/20 0.34
GANC Q8TET4 2/20 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
SCHEMBL505960 0.86 PNP (0.54) PNPMGAMAGLGAAGLA
SCHEMBL506137 0.82 PNP (0.40) PNP
SCHEMBL505443 0.80 PNP (0.35) PNP
SCHEMBL505433 0.80 PNP (0.62) PNPMGAMAGLGBA2
SCHEMBL506021 0.76 PNP (0.39) PNP
SCHEMBL506292 0.72 PNP (0.38) PNP
SCHEMBL5606739 0.70 PNP (0.60) PNP
SCHEMBL506019 0.70 PNP (0.60) PNP
SCHEMBL7100238 0.70 PNP (0.60) PNP
Hydrochloric Acid SCHEMBL4065724 0.69 PNP (0.59) PNP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1023308-B1 INHIBITORS OF NUCLEOSIDE METABOLISM EINSTEIN COLL MED (US) 2005-09-07 EP claimed
US-6660719-B2 Inhibiting T-Cell proliferation BIOCRYST PHARMACEUTICALS INC. 2003-12-09 US claimed
US-20030114466-A1 Inhibiting T-cell proliferation BIOCRYST PHARMACEUTICALS, INC. 2003-06-19 US claimed
US-20030096830-A1 Inhibitors of nucleoside metabolism BIOCRYST PHARMACEUTICALS, INC. 2003-05-22 US claimed
US-20020061898-A1 Inhibitors of nucleoside metabolism BIOCRYST PHARMACEUTICALS, INC. 2002-05-23 US claimed
US-20170216272-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-08-03 US disclosed
US-9597347-B2 Compositions for treating obesity and insulin resistance disorders PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-03-21 US disclosed
EP-3031461-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS The President and Fellows of Harvard College (US) 2016-06-15 EP disclosed
US-9241916-B2 Cognitive performance with sirtuin activators PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2016-01-26 US disclosed
US-20150133396-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-05-14 US disclosed
US-8846724-B2 Compositions for treating obesity and insulin resistance disorders PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2014-09-30 US disclosed
US-8242171-B2 Method for reducing the weight of a subject or inhibiting weight gain in a subject PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-08-14 US disclosed
US-6660719-B2 Inhibiting T-Cell proliferation BIOCRYST PHARMACEUTICALS INC. 2003-12-09 US disclosed
US-20030114466-A1 Inhibiting T-cell proliferation BIOCRYST PHARMACEUTICALS, INC. 2003-06-19 US disclosed
US-20030096830-A1 Inhibitors of nucleoside metabolism BIOCRYST PHARMACEUTICALS, INC. 2003-05-22 US disclosed
US-6492347-B2 TREATMENT AND/OR PROPHYLAXIS OF INFECTION CAUSED BY PROTOZOAN PARASITE BY ADMINISTERING COMPOUND TO INHIBIT PURINE NUCLEOSIDE HYDROLASE, PURINE NUCLEOSIDE PHOSPHORYLASE, AND/OR PURINE PHOSPHORIBOSYL TRANSFERASE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY 2002-12-10 US disclosed
US-20020061898-A1 Inhibitors of nucleoside metabolism BIOCRYST PHARMACEUTICALS, INC. 2002-05-23 US disclosed
US-6228847-B1 ADMINISTERING PYRROLO(3,2-D)PYRIMIDINE DERIVATIVES AS PURINE NUCLEOSIDE PHOSPHORYLASE INHIBITOR ALBERT EINSTEIN COLLEGE OF MEDICINE 2001-05-08 US disclosed
US-6066722-A Inhibitors of nucleoside metabolism ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2000-05-23 US disclosed
US-5985848-A EFFECTIVE INHIBITORS OF PURINE NUCLEOSIDE PHOSPHORYLASE AND/OR NUCLEOSIDE HYDROLASES; TREATMENT AND/OR PROPHYLAXIS OF A PROTOZOAN INFECTION ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 1999-11-16 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 (5 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-20150133396-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS FABP4, GPR119, SIRT1 PNP 3921/4885MGAM 895/4885AGL 2716/4885
US-20020061898-A1 Inhibitors of nucleoside metabolism PNP, APRT, NUDT14 PNP 1/4885MGAM 577/4885AGL 228/4885
US-20030114466-A1 Inhibiting T-cell proliferation PNP, TYMP, ENTPD5 PNP 1/4885MGAM 488/4885AGL 1322/4885
US-20170216272-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS FABP4, GPR119, SIRT1 PNP 3921/4885MGAM 895/4885AGL 2716/4885
US-20030096830-A1 Inhibitors of nucleoside metabolism CFH, NADK, UGT1A3 PNP 35/4885MGAM 1713/4885AGL 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.