SCHEMBL3878862

SCHEMBL3878862

CC(=O)OC1O[C@H](CO)[C@@H](OC(C)=O)[C@H]1OC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ OGA O60502 1/20 0.46
▸ CA2 P00918 6/20 0.45
▸ CA1 P00915 5/20 0.43
▸ CA4 P22748 4/20 0.43
▸ CA5A P35218 4/20 0.43
▸ CA5B Q9Y2D0 4/20 0.43
▸ CA12 O43570 4/20 0.43
▸ CA7 P43166 3/20 0.43
▸ PRKCA P17252 2/20 0.40
▸ PRKD3 O94806 1/20 0.40
▸ PRKCG P05129 1/20 0.40
▸ PRKCB P05771 1/20 0.40
▸ PRKCH P24723 1/20 0.40
▸ PRKCE Q02156 1/20 0.40
▸ PRKCQ Q04759 1/20 0.40
▸ PRKCD Q05655 1/20 0.40
▸ PRKD1 Q15139 1/20 0.40

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
SCHEMBL1800609 1.00 CYP2D6 (0.49) CYP2D6THRBHSD17B10OGACA2
SCHEMBL1800607 1.00 CYP2D6 (0.49) CYP2D6THRBHSD17B10OGACA2
SCHEMBL17889827 1.00 CYP2D6 (0.49) CYP2D6THRBHSD17B10OGACA2
SCHEMBL6376930 1.00 CYP2D6 (0.49) CYP2D6THRBHSD17B10OGACA2
SCHEMBL1800610 1.00 CYP2D6 (0.49) CYP2D6THRBHSD17B10OGACA2
SCHEMBL17736190 1.00 CYP2D6 (0.49) CYP2D6THRBHSD17B10OGACA2
SCHEMBL17571769 1.00 CYP2D6 (0.49) CYP2D6THRBHSD17B10OGACA2
SCHEMBL14307748 1.00 CYP2D6 (0.49) CYP2D6THRBHSD17B10OGACA2
SCHEMBL314060 0.98 CYP2D6 (0.51) CYP2D6THRBHSD17B10OGACA2
SCHEMBL4619592 0.98 CYP2D6 (0.51) CYP2D6THRBHSD17B10OGACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4284388-A1 ETHYL CELLULOSE BASED COATINGS FOR MICROENCAPSULATION OF NICOTINAMIDE RIBOSIDE AND OTHER NICOTINYL RIBOSIDE COMPOUNDS Chromadex, Inc. (US) 2023-12-06 — — EP disclosed
US-20230348521-A1 METHODS OF SYNTHESIZING NICOTINAMIDE RIBOSIDE ELYSIUM HEALTH, INC. 2023-11-02 — — US disclosed
US-11767314-B2 Bioenergetic nicotinic acid glycerol esters, compositions and methods of using same CONOPCO, INC. (US) 2023-09-26 — — US disclosed
US-11629163-B2 Methods of synthesizing nicotinamide riboside ELYSIUM HEALTH, INC. (US) 2023-04-18 — — US disclosed
EP-3873415-A1 BIOENERGETIC NICOTINIC ACID GLYCEROL ESTERS, COMPOSITIONS AND METHODS OF USING SAME UNILEVER GLOBAL IP LIMITED (GB) 2021-09-08 — — EP disclosed
US-20200140475-A1 METHODS OF SYNTHESIZING NICOTINAMIDE RIBOSIDE ELYSIUM HEALTH, INC. 2020-05-07 — — US disclosed
WO-2019006262-A1 METHODS OF SYNTHESIZING NICOTINAMIDE RIBOSIDE ELYSIUM HEALTH, INC. (US) 2019-01-03 — — WO disclosed
WO-2018033639-A1 LACTONE INTERMEDIATES OF NICOTINAMIDE RIBOSIDE AND NICOTINATE RIBOSIDE THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2018-02-22 — — WO disclosed
US-20180037601-A1 Nucleoside-Based Anti-Bacterial and Anti-Protozoan Drugs UTI LIMITED PARTNERSHIP (CA) 2018-02-08 — — US disclosed
US-20180037601-A1 Nucleoside-Based Anti-Bacterial and Anti-Protozoan Drugs UTI LIMITED PARTNERSHIP (CA) 2018-02-08 — — US disclosed
US-20040235761-A1 Novel virus proliferaton inhibition/virucidal method and novel pyradine nucleotide/pyradine nucleoside analogue TOYAMA CHEMICAL CO., LTD. (JP) 2004-11-25 — — US disclosed
US-6800629-B2 VIRICIDES TOYAMA CHEMICAL CO., LTD. (JP) 2004-10-05 — — US disclosed
US-20030130213-A1 Novel pyrazine derivatives or salts thereof, pharmaceutical composition containing the same, and production intermediates thereof TOYAMA CHEMICAL CO., LTD. (JP) 2003-07-10 — — US disclosed
EP-1295890-A1 Novel pyrazine derivatives or salts thereof, pharmaceutical composition containing the same, and production intermediates thereof TOYAMA CHEMICAL CO., LTD. (JP) 2003-03-26 — — EP disclosed
EP-1256588-A1 NOVEL PYRAZINE DERIVATIVES OR SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THE DERIVATIVES OR THE SALTS AND INTERMEDIATES FOR THE PREPARATION OF BOTH TOYAMA CHEMICAL CO., LTD. (JP) 2002-11-13 — — EP disclosed
US-20020052345-A1 Novel prodrugs for phosphorus-containing compounds METABASIS THERAPEUTICS, INC. 2002-05-02 — — US disclosed
US-6312662-B1 CONVERSION BY HUMAN LIVER MICROSOMES TO MPO3H2 METABASIS THERAPEUTICS, INC. 2001-11-06 — — US disclosed
EP-1060182-A2 NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS Metabasis Therapeutics, Inc. (US) 2000-12-20 — — EP disclosed
WO-1999045016-A9 NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS METABASIS THERAPEUTICS INC (US) 2000-03-02 — — WO disclosed
WO-1999045016-A2 NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS METABASIS THERAPEUTICS, INC. (US) 1999-09-10 — — 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 (8 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-20230348521-A1 METHODS OF SYNTHESIZING NICOTINAMIDE RIBOSIDE NAMPT, NADK, NNT CYP2D6 2669/4885THRB 1741/4885HSD17B10 658/4885
US-20180037601-A1 Nucleoside-Based Anti-Bacterial and Anti-Protozoan Drugs PNP, NUDT1, SLC29A1 CYP2D6 1804/4885THRB 4801/4885HSD17B10 4454/4885
US-20030130213-A1 Novel pyrazine derivatives or salts thereof, pharmaceutical composition containing the same, and production intermediates thereof GTF3C5, EIF2AK2, GTF3C2 CYP2D6 82/4885THRB 3824/4885HSD17B10 983/4885
US-11767314-B2 Bioenergetic nicotinic acid glycerol esters, compositions and methods of using same PRKAG1, PRKAB1, PRKAG2 CYP2D6 4700/4885THRB 2014/4885HSD17B10 1391/4885
US-11629163-B2 Methods of synthesizing nicotinamide riboside NAMPT, NADK, NNT CYP2D6 2669/4885THRB 1741/4885HSD17B10 658/4885
US-20020052345-A1 Novel prodrugs for phosphorus-containing compounds CCRL2, CCR4, ALK CYP2D6 172/4885THRB 235/4885HSD17B10 994/4885
US-20200140475-A1 METHODS OF SYNTHESIZING NICOTINAMIDE RIBOSIDE NAMPT, NADK, NNT CYP2D6 2669/4885THRB 1741/4885HSD17B10 658/4885
US-20040235761-A1 Novel virus proliferaton inhibition/virucidal method and novel pyradine nucleotide/pyradine nucleoside analogue CDK5, NT5C3B, CDK15 CYP2D6 2222/4885THRB 2563/4885HSD17B10 4712/4885

“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.

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