SCHEMBL2723648

SCHEMBL2723648

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

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 2/20 0.70
▸ THRB P10828 1/20 0.70
▸ HSD17B10 Q99714 1/20 0.70
▸ CA2 P00918 7/20 0.62
▸ TSHR P16473 1/20 0.56
▸ NR3C1 P04150 1/20 0.56
▸ FYN P06241 1/20 0.56
▸ ADRA2A P08913 1/20 0.56
▸ ADORA3 P0DMS8 1/20 0.56
▸ ADRA2B P18089 1/20 0.56
▸ DRD4 P21917 1/20 0.56
▸ DRD3 P35462 1/20 0.56
▸ CA12 O43570 6/20 0.55
▸ CA1 P00915 5/20 0.55
▸ CA9 Q16790 4/20 0.55
▸ LMNA P02545 2/20 0.54
▸ CA4 P22748 2/20 0.51
▸ CA5A P35218 2/20 0.51
▸ CA7 P43166 2/20 0.51
▸ CA5B Q9Y2D0 2/20 0.51

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
SCHEMBL77518 1.00 CYP2D6 (0.70) CYP2D6THRBHSD17B10CA2TSHR
SCHEMBL17327517 1.00 CYP2D6 (0.70) CYP2D6THRBHSD17B10CA2TSHR
SCHEMBL19735717 1.00 CYP2D6 (0.70) CYP2D6THRBHSD17B10CA2TSHR
SCHEMBL5410915 1.00 CYP2D6 (0.70) CYP2D6THRBHSD17B10CA2TSHR
SCHEMBL24584612 1.00 CYP2D6 (0.70) CYP2D6THRBHSD17B10CA2TSHR
SCHEMBL20524278 1.00 CYP2D6 (0.70) CYP2D6THRBHSD17B10CA2TSHR
SCHEMBL23330709 1.00 CYP2D6 (0.70) CYP2D6THRBHSD17B10CA2TSHR
SCHEMBL258821 1.00 CYP2D6 (0.70) CYP2D6THRBHSD17B10CA2TSHR
SCHEMBL502378 1.00 CYP2D6 (0.70) CYP2D6THRBHSD17B10CA2TSHR
SCHEMBL13396023 1.00 CYP2D6 (0.70) CYP2D6THRBHSD17B10CA2TSHR

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
WO-2003002586-A1 [4-(4-CYANOBENZOYL)PHENYL]GLYCOFURANOSIDE DERIVATIVES, USE OF SAID DERIVATIVES AS A MEDICAMENT, PRODUCTION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LABORATOIRES FOURNIER SA (FR) 2003-01-09 — — WO claimed
JP-1319496-A — — None — — JP disclosed
CN-110291095-B Adenosine analogues and their use in regulating circadian clock 北京生命科学研究所 2023-04-18 — — CN disclosed
US-20210338706-A1 ADENOSINE ANALOG AND ITS USE IN REGULATING THE CIRCADIAN CLOCK NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-11-04 — — US disclosed
US-9062088-B2 CDK-inhibiting pyrrolopyrimidine carboxamide derivative or pharmaceutically acceptable salt thereof, and pharmaceutical composition containing the same as active ingredient for preventing or treating hepatocellular carcinoma SNU R&DB FOUNDATION (KR) 2015-06-23 — — US disclosed
US-20130237495-A1 CDK-INHIBITING PYRROLOPYRIMIDINONE CARBOXAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING HEPATOCELLULAR CARCINOMA SNU R&DB FOUNDATION (KR) 2013-09-12 — — US disclosed
EP-2636677-A1 CDK-INHIBITING PYRROLOPYRIMIDINONE CARBOXAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING LIVER CELL CANCER SNU R & DB Foundation (KR) 2013-09-11 — — EP disclosed
US-8389565-B2 Antidiabetic agents; controlling carbohydrate metabolism SIMON FRASER UNIVERSITY (CA) 2013-03-05 — — US disclosed
WO-2012060482-A1 CDK-INHIBITING PYRROLOPYRIMIDINONE CARBOXAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING LIVER CELL CANCER 서울대학교 산학협력단 (KR) 2012-05-10 — — WO disclosed
US-20090048203-A1 SUBSTITUTED ADENINES AND THE USES THEREOF ASTRAZENECA AB (SE) 2009-02-19 — — US disclosed
US-5599796-A USING BORON CLUSTER-CONTAINING NUCLEOSIDES OR OLIGONUCLEOTIDES; PARTICULARLY EFFECTIVE FOR BLADDER, PROSTATE AND KIDNEY EMORY UNIVERSITY (US) 1997-02-04 — — US disclosed
US-5596087-A Process for the preparation of beta thymidine COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 1997-01-21 — — US disclosed
EP-0683171-A1 A process for the preparation of beta-thymidine Council of Scientific and Industrial Research (IN) 1995-11-22 — — EP disclosed
EP-0348446-B1 ANTIVIRAL ANTITUMOR ANTIMETASTATIC IMMUNE SYSTEM ENHANCING NUCLEOSIDES AND NUCLEOTIDES UNIV BRIGHAM YOUNG (US) 1995-08-09 — — EP disclosed
EP-0636372-A1 Antiviral, antitumor, antimetastatic, immune system enhancing 7-thia-guanosine derivatives BRIGHAM YOUNG UNIVERSITY (US) 1995-02-01 — — EP disclosed
EP-0348446-A4 ANTIVIRAL ANTITUMOR ANTIMETASTATIC IMMUNE SYSTEM ENHANCING NUCLEOSIDES AND NUCLEOTIDES — 1991-09-25 — — EP disclosed
US-5041426-A Viricides, antitumor agents BRIGHAM YOUNG UNIVERSITY (US) 1991-08-20 — — US disclosed
EP-0348446-A1 ANTIVIRAL ANTITUMOR ANTIMETASTATIC IMMUNE SYSTEM ENHANCING NUCLEOSIDES AND NUCLEOTIDES. UNIV BRIGHAM YOUNG (US) 1990-01-03 — — EP disclosed
JP-H01319496-A URACIL DERIVATIVE T HASEGAWA CO LTD 1989-12-25 — — JP disclosed
WO-1989005649-A1 ANTIVIRAL ANTITUMOR ANTIMETASTATIC IMMUNE SYSTEM ENHANCING NUCLEOSIDES AND NUCLEOTIDES BRIGHAM YOUNG UNIVERSITY (US) 1989-06-29 — — 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 (3 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-20090048203-A1 SUBSTITUTED ADENINES AND THE USES THEREOF HPRT1, APRT, NUDT1 CYP2D6 301/4885THRB 3402/4885HSD17B10 1880/4885
US-20130237495-A1 CDK-INHIBITING PYRROLOPYRIMIDINONE CARBOXAMIDE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING HEPATOCELLULAR CARCINOMA CDK7, CDK4, CDK14 CYP2D6 2324/4885THRB 4725/4885HSD17B10 2634/4885
US-20210338706-A1 ADENOSINE ANALOG AND ITS USE IN REGULATING THE CIRCADIAN CLOCK PER2, CRY1, ADORA2A CYP2D6 3612/4885THRB 1199/4885HSD17B10 3429/4885

“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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