SCHEMBL258821

SCHEMBL258821

CC(=O)OC[C@H]1OC(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
SCHEMBL2723648 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 299 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11530233-B2 Beta-nicotinate ester nucleotides and processes for preparing same CORNELL UNIVERSITY (US) 2022-12-20 — — US claimed
CN-110709406-B Beta-nicotinate nucleotide and preparation method thereof 康奈尔大学 2022-11-08 — — CN claimed
US-20210388018-A1 METHYL AND ETHYL NICOTINATE-RIBOSIDE-5-PHOSPHATES, PREPARATION THEREOF AND METHODS OF USE THEREOF CORNELL UNIVERSITY (US) 2021-12-16 — — US claimed
US-20210214386-A1 BETA-NICOTINATE ESTER NUCLEOTIDES AND PROCESSES FOR PREPARING SAME CORNELL UNIVERSITY (US) 2021-07-15 — — US claimed
EP-3606929-B1 BETA-NICOTINATE ESTER NUCLEOTIDES AND PROCESSES FOR PREPARING SAME UNIV CORNELL (US) 2021-06-02 — — EP claimed
US-10961268-B2 β-nicotinate ester nucleotides and process for preparing same CORNELL UNIVERSITY (US) 2021-03-30 — — US claimed
EP-3606929-A1 BETA-NICOTINATE ESTER NUCLEOTIDES AND PROCESSES FOR PREPARING SAME Cornell University (US) 2020-02-12 — — EP claimed
US-20200031860-A1 BETA-NICOTINATE ESTER NUCLEOTIDES AND PROCESS FOR PREPARING SAME CORNELL UNIVERSITY (US) 2020-01-30 — — US claimed
CN-110709406-A Beta-nicotinate nucleotide and preparation method thereof 康奈尔大学 2020-01-17 — — CN claimed
WO-2018187540-A1 BETA-NICOTINATE ESTER NUCLEOTIDES AND PROCESSES FOR PREPARING SAME CORNELL UNIVERSITY (US) 2018-10-11 — — WO claimed
US-9266863-B2 Process for the synthesis of azacitidine and decitabine CHEMI SPA (IT) 2016-02-23 — — US claimed
EP-2371825-B1 Process for the synthesis of azacitidine and decitabine CHEMI SPA (IT) 2014-01-08 — — EP claimed
US-20110245485-A1 PROCESS FOR THE SYNTHESIS OF AZACITIDINE AND DECITABINE CHEMI SPA (IT) 2011-10-06 — — US claimed
EP-2371825-A1 Process for the synthesis of azacitidine and decitabine Chemi SPA (IT) 2011-10-05 — — EP claimed
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
US-4914233-A Synthesis of beta-thymidine ETHYL CORPORATION (US) 1990-04-03 — — US claimed
JP-2292297-A — — None — — JP disclosed
EP-4744667-A2 EFFICIENT AND SCALABLE SYNTHESES OF NICOTINOYL RIBOSIDES AND REDUCED NICOTINOYL RIBOSIDES, MODIFIED DERIVATIVES THEREOF, PHOSPHORYLATED ANALOGS THEREOF, ADENYLYL DINUCLEOTIDE CONJUGATES THEREOF, AND NOVEL CRYSTALLINE FORMS THEREOF The Queen's University Of Belfast (GB) 2026-05-20 — — EP disclosed
US-4056674-A VIRICIDE, BACTERICIDE ICN PHARMACEUTICALS, INC. (US) 1977-11-01 — — US disclosed
US-3954752-A Process for preparing 2',3',5'-tri-0-acetyl-6-azauridine CESKOSLOVENSKA AKADEMIE VED (CS) 1976-05-04 — — 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 (6 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-10961268-B2 β-nicotinate ester nucleotides and process for preparing same NAPRT, NAMPT, NNT CYP2D6 1338/4885THRB 1033/4885HSD17B10 1442/4885
US-20110245485-A1 PROCESS FOR THE SYNTHESIS OF AZACITIDINE AND DECITABINE DNMT1, TET1, TET2 CYP2D6 969/4885THRB 3467/4885HSD17B10 3882/4885
US-20210214386-A1 BETA-NICOTINATE ESTER NUCLEOTIDES AND PROCESSES FOR PREPARING SAME NAPRT, NAMPT, NNT CYP2D6 1499/4885THRB 1053/4885HSD17B10 1588/4885
US-20200031860-A1 BETA-NICOTINATE ESTER NUCLEOTIDES AND PROCESS FOR PREPARING SAME NAPRT, NAMPT, NNT CYP2D6 1543/4885THRB 1031/4885HSD17B10 1525/4885
US-11530233-B2 Beta-nicotinate ester nucleotides and processes for preparing same NAPRT, NAMPT, NNT CYP2D6 1499/4885THRB 1053/4885HSD17B10 1588/4885
US-20210388018-A1 METHYL AND ETHYL NICOTINATE-RIBOSIDE-5-PHOSPHATES, PREPARATION THEREOF AND METHODS OF USE THEREOF NNT, NME4, NADK CYP2D6 2514/4885THRB 4035/4885HSD17B10 2065/4885

“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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