SCHEMBL77518

SCHEMBL77518

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2831253-B1 ENZYMES USEFUL FOR PERACID PRODUCTION DUPONT US HOLDING LLC (US) 2021-11-24 — — EP claimed
US-8962294-B2 Perhydrolase variant providing improved specific activity E. I. DU PONT DE NEMOURS AND COMPANY (US) 2015-02-24 — — US claimed
US-8956843-B2 Perhydrolase variant providing improved specific activity E. I. DU PONT DE NEMOURS AND COMPANY (US) 2015-02-17 — — US claimed
EP-2831253-A1 ENZYMES USEFUL FOR PERACID PRODUCTION E. I. Du Pont de Nemours and Company (US) 2015-02-04 — — EP claimed
EP-2831226-A1 ENZYMES USEFUL FOR PERACID PRODUCTION E. I. Du Pont de Nemours and Company (US) 2015-02-04 — — EP claimed
EP-2831252-A1 ENZYMES USEFUL FOR PERACID PRODUCTION E. I. Du Pont de Nemours and Company (US) 2015-02-04 — — EP claimed
EP-2831250-A1 ENZYMES USEFUL FOR PERACID PRODUCTION E. I. Du Pont de Nemours and Company (US) 2015-02-04 — — EP claimed
EP-2831251-A1 ENZYMES USEFUL FOR PERACID PRODUCTION E. I. Du Pont de Nemours and Company (US) 2015-02-04 — — EP claimed
US-8911977-B2 Enzymes useful for peracid production E. I. DU PONT DE NEMOURS AND COMPANY (US) 2014-12-16 — — US claimed
US-8865436-B2 Enzymes useful for peracid production E. I. DU PONT DE NEMOURS AND COMPANY (US) 2014-10-21 — — US claimed
US-20080176783-A1 Production of Peracids Using An Enzyme Having Perhydrolysis Activity DUPONT US HOLDING, LLC 2008-07-24 — — US claimed
US-20080176299-A1 PRODUCTION OF PERACIDS USING AN ENZYME HAVING PERHYDROLYSIS ACTIVITY DUPONT US HOLDING, LLC 2008-07-24 — — US claimed
WO-2008073139-A1 PRODUCTION OF PERACIDS USING AN ENZYME HAVING PERHYDROLYSIS ACTIVITY E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-06-19 — — WO claimed
US-6800742-B2 Method for producing β-D-ribofuranose derivatives or optical isomers thereof AJINOMOTO CO., INC. (JP) 2004-10-05 — — US claimed
US-20020187942-A1 Method for producing beta-D-ribofuranose derivatives or optical isomers thereof AJINOMOTO CO., INC. (JP) 2002-12-12 — — US claimed
EP-1260516-A1 Method for producing a beta-D-ribofuranose derivative or an optical isomer thereof Ajinomoto Co., Inc. (JP) 2002-11-27 — — EP claimed
EP-0193903-B1 PRODUCTION OF CYTOSINE NUCLEOSIDES Takeda Chemical Industries, Ltd. (JP) 1990-06-13 — — EP claimed
US-4801698-A Process for preparing diaminopyrimido(4,5-d)pyrimidine glycoside and glycotide WARNER-LAMBERT COMPANY (US) 1989-01-31 — — US claimed
US-4689404-A Production of cytosine nucleosides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-08-25 — — US claimed
EP-0193903-A2 Production of cytosine nucleosides Takeda Chemical Industries, Ltd. (JP) 1986-09-10 — — EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20020187942-A1 Method for producing beta-D-ribofuranose derivatives or optical isomers thereof DERA, RNGTT, DUT CYP2D6 302/4885THRB 1004/4885HSD17B10 1438/4885

“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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