SCHEMBL9914097

SCHEMBL9914097

CC(C)[C@@H]1OC(CO)[C@@H](O)CC1O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OGA O60502 4/20 0.36
PDE4D Q08499 2/20 0.35
SLC5A2 P31639 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PTPN1 P18031 1/20 0.31
HIF1A Q16665 1/20 0.31
TK2 O00142 1/20 0.31
TK1 P04183 1/20 0.31
PIM1 P11309 1/20 0.31
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
CSNK2A1 P68400 1/20 0.31
CSNK2A3 Q8NEV1 1/20 0.31
ADRB1 P08588 1/20 0.31
DNMT1 P26358 1/20 0.31

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
SCHEMBL14025413 1.00 OGA (0.36) OGAPDE4DSLC5A2ALDH1A1TSHR
SCHEMBL23640105 1.00 OGA (0.36) OGAPDE4DSLC5A2ALDH1A1TSHR
SCHEMBL26309581 1.00 OGA (0.36) OGAPDE4DSLC5A2ALDH1A1TSHR
SCHEMBL23640147 0.83 OGA (0.35) OGAPDE4DSLC5A2TK2TK1
SCHEMBL20154818 0.78 OGA (0.41) OGAPDE4DSLC5A2ALDH1A1TSHR
SCHEMBL12694172 0.78 OGA (0.41) OGAPDE4DSLC5A2ALDH1A1TSHR
SCHEMBL14257090 0.78 OGA (0.37) OGAPDE4DSLC5A2LMNAHIF1A
SCHEMBL13656418 0.78 OGA (0.37) OGAPDE4DSLC5A2LMNAHIF1A
SCHEMBL16216989 0.78 OGA (0.37) OGAPDE4DSLC5A2LMNAHIF1A
SCHEMBL17225755 0.78 OGA (0.37) OGAPDE4DSLC5A2LMNAHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9469864-B2 Reversible natural product glycosyltransferase-catalyzed reactions, compounds and related methods WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2016-10-18 US disclosed
US-20150141294-A1 REVERSIBLE NATURAL PRODUCT GLYCOSYLTRANSFERASE-CATALYZED REACTIONS, COMPOUNDS AND RELATED METHODS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-05-21 US disclosed
US-8841092-B2 Reversible natural product glycosyltransferase-catalyzed reactions, compounds and related methods WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2014-09-23 US disclosed
US-20130012466-A1 COLCHICINE NEOGLYCOSIDES AND METHODS FOR THEIR SYNTHESIS AND USE WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-01-10 US disclosed
US-20120264924-A1 Glycorandomization and Production of Novel Novobiocin Analogs WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-10-18 US disclosed
US-8232254-B2 Colchicine glycosylated to include a sugar moiety on a methoxyamino-appended colchicine; cytolysis equivalent to paclitaxel and doxorubicin; stabilizers of tubulin formation; anticarcinogenic -arthritic agents; Mediterranean fever, amyloidosis, scleroderma, irritable bowel syndrome or gout WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-07-31 US disclosed
US-8232254-B2 Colchicine glycosylated to include a sugar moiety on a methoxyamino-appended colchicine; cytolysis equivalent to paclitaxel and doxorubicin; stabilizers of tubulin formation; anticarcinogenic -arthritic agents; Mediterranean fever, amyloidosis, scleroderma, irritable bowel syndrome or gout WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-07-31 US disclosed
US-8198419-B2 Glycorandomization and production of novel erythromycin analogs WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-06-12 US disclosed
US-20110124850-A1 Glycorandomization and Production of Novel Vancomycin Analogs THORSON JON 2011-05-26 US disclosed
US-20090275485-A1 Reversible Natural Product Glycosyltransferase-Catalyzed Reactions, Compounds and Related Methods WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2009-11-05 US disclosed
WO-2008067039-A9 COLCHICINE NEOGLYCOSIDES AND METHODS FOR THEIR SYNTHESIS AND USE WISCONSIN ALUMNI RES FOUND (US) 2008-10-16 WO disclosed
US-20080171787-A1 COLCHICINE NEOGLYCOSIDES AND METHODS FOR THEIR SYNTHESIS AND USE WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-07-17 US disclosed
US-20080171787-A1 COLCHICINE NEOGLYCOSIDES AND METHODS FOR THEIR SYNTHESIS AND USE WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-07-17 US disclosed
WO-2008067039-A2 COLCHICINE NEOGLYCOSIDES AND METHODS FOR THEIR SYNTHESIS AND USE WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-06-05 WO disclosed
US-7348309-B2 Glycorandomization and production of novel vancomycin analogs WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-03-25 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-20080171787-A1 COLCHICINE NEOGLYCOSIDES AND METHODS FOR THEIR SYNTHESIS AND USE TUBB6, TUBB, TUBA1C OGA 487/4885PDE4D 3446/4885SLC5A2 1034/4885
US-20110124850-A1 Glycorandomization and Production of Novel Vancomycin Analogs NMT1, NMT2, B3GNT2 OGA 64/4885PDE4D 2257/4885SLC5A2 418/4885
US-20130012466-A1 COLCHICINE NEOGLYCOSIDES AND METHODS FOR THEIR SYNTHESIS AND USE TUBB6, TUBB, TUBA1C OGA 487/4885PDE4D 3446/4885SLC5A2 1034/4885
US-20090275485-A1 Reversible Natural Product Glycosyltransferase-Catalyzed Reactions, Compounds and Related Methods UGGT1, ENGASE, CSGALNACT1 OGA 109/4885PDE4D 2653/4885SLC5A2 961/4885
US-20120264924-A1 Glycorandomization and Production of Novel Novobiocin Analogs NMT2, NMT1, NAMPT OGA 90/4885PDE4D 1405/4885SLC5A2 392/4885

“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.