SCHEMBL505494

SCHEMBL505494

CCSOC[C@H]1N[C@@H](c2c[nH]c3c(O)nc(O)nc23)[C@H](O)[C@@H]1O

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTAP Q13126 8/20 0.45
HPRT1 P00492 2/20 0.44
PNP P00491 9/20 0.42

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
SCHEMBL4840335 0.89 HPRT1 (0.48) MTAPHPRT1PNP
SCHEMBL5606739 0.81 PNP (0.60) MTAPHPRT1PNP
SCHEMBL7100238 0.81 PNP (0.60) MTAPHPRT1PNP
SCHEMBL506019 0.81 PNP (0.60) MTAPHPRT1PNP
Hydrochloric Acid SCHEMBL4065724 0.80 PNP (0.59) MTAPHPRT1PNP
SCHEMBL505499 0.80 HPRT1 (0.50) MTAPHPRT1PNP
SCHEMBL505834 0.76 PNP (0.55) MTAPHPRT1PNP
SCHEMBL505684 0.75 MTAP (0.59) MTAPHPRT1PNP
SCHEMBL14156772 0.72 PNP (0.58) MTAPPNP
SCHEMBL4834827 0.70 HPRT1 (0.70) MTAPHPRT1PNP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20120135091-A1 METHODS AND COMPOSITIONS FOR ENHANCING LIFESPAN INVOLVING SIRTUIN-MODULATING COMPOUNDS AND CHALCOGENIDES US ARMY, SECRETARY OF THE ARMY 2012-05-31 US disclosed
US-20120029065-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS THE GENERAL HOSPITAL CORPORATION D/B/A MASSACHUSETTS GENERAL HOSPITAL (US) 2012-02-02 US disclosed
US-8017634-B2 Compositions for treating obesity and insulin resistance disorders PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-09-13 US disclosed
US-20100316679-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-12-16 US disclosed
US-20080194803-A1 Cognitive Performance With Sirtuin Activators HOWARD HUGHES MEDICAL INSTITUTE 2008-08-14 US disclosed
US-20070149466-A1 Methods and related compositions for treating or preventing obesity, insulin resistance disorders, and mitochondrial-associated disorders SIRTRIS PHARMACEUTICALS, INC. 2007-06-28 US disclosed
US-20070014833-A1 Treatment of eye disorders with sirtuin modulators SIRTRIS PHARMACEUTICALS, INC. (US) 2007-01-18 US disclosed
US-20060292099-A1 Treatment of eye disorders with sirtuin modulators SIRTRIS PHARMACEUTICALS, INC. 2006-12-28 US disclosed
US-20060276416-A1 Methods and compositions for treating flushing and drug induced weight gain SIRTRIS PHARMACEUTICALS, INC. (US) 2006-12-07 US disclosed
US-20060276393-A1 Novel compositions for preventing and treating neurodegenerative and blood coagulation disorders SIRTRIS PHARMACEUTICALS, INC. (US) 2006-12-07 US disclosed
US-20060111435-A1 Contacting cells with sirtuin activator or inhibitor; increasing or decreasing fat accumulation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2006-05-25 US disclosed
US-20050171027-A1 Compositions for treating or preventing obesity and insulin resistance disorders PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2005-08-04 US disclosed
US-20020061898-A1 Inhibitors of nucleoside metabolism BIOCRYST PHARMACEUTICALS, INC. 2002-05-23 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 (14 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-20060111435-A1 Contacting cells with sirtuin activator or inhibitor; increasing or decreasing fat accumulation FABP4, PLIN1, SIRT1 MTAP 2994/4885HPRT1 4402/4885PNP 3367/4885
US-20150133396-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS FABP4, GPR119, SIRT1 MTAP 3429/4885HPRT1 4585/4885PNP 3921/4885
US-20020061898-A1 Inhibitors of nucleoside metabolism PNP, APRT, NUDT14 MTAP 34/4885HPRT1 6/4885PNP 1/4885
US-20060276416-A1 Methods and compositions for treating flushing and drug induced weight gain SIRT2, SIRT1, SIRT7 MTAP 2952/4885HPRT1 2843/4885PNP 3378/4885
US-20100316679-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS FABP4, GPR119, SIRT1 MTAP 3429/4885HPRT1 4585/4885PNP 3921/4885
US-20170216272-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS FABP4, GPR119, SIRT1 MTAP 3429/4885HPRT1 4585/4885PNP 3921/4885
US-20070014833-A1 Treatment of eye disorders with sirtuin modulators SIRT1, SIRT2, SIRT3 MTAP 4736/4885HPRT1 2456/4885PNP 4397/4885
US-20120135091-A1 METHODS AND COMPOSITIONS FOR ENHANCING LIFESPAN INVOLVING SIRTUIN-MODULATING COMPOUNDS AND CHALCOGENIDES HSF1, SIRT1, SIRT2 MTAP 2311/4885HPRT1 4015/4885PNP 4175/4885
US-20060276393-A1 Novel compositions for preventing and treating neurodegenerative and blood coagulation disorders SIRT2, SIRT1, SIRT3 MTAP 4283/4885HPRT1 2407/4885PNP 3481/4885
US-20060292099-A1 Treatment of eye disorders with sirtuin modulators SIRT1, SIRT2, SIRT3 MTAP 4736/4885HPRT1 2456/4885PNP 4397/4885
US-20080194803-A1 Cognitive Performance With Sirtuin Activators SIRT1, SIRT2, SIRT7 MTAP 935/4885HPRT1 3206/4885PNP 2309/4885
US-20120029065-A1 COMPOSITIONS FOR TREATING OR PREVENTING OBESITY AND INSULIN RESISTANCE DISORDERS FABP4, GPR119, SIRT1 MTAP 3429/4885HPRT1 4585/4885PNP 3921/4885
US-20070149466-A1 Methods and related compositions for treating or preventing obesity, insulin resistance disorders, and mitochondrial-associated disorders SIRT1, SIRT3, SIRT2 MTAP 4093/4885HPRT1 3637/4885PNP 2885/4885
US-20050171027-A1 Compositions for treating or preventing obesity and insulin resistance disorders FABP4, GPR119, SIRT1 MTAP 3429/4885HPRT1 4585/4885PNP 3921/4885

“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.