SCHEMBL3673113

SCHEMBL3673113

COc1ccc(CCC(=O)c2sccc2OC2OC(CO)C(O)C(O)C2O)cc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SLC5A1 P13866 15/20 0.66
▸ SLC5A2 P31639 12/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ HPGD P15428 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ SLC28A3 Q9HAS3 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ THRB P10828 1/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ SLC28A2 O43868 1/20 0.54
▸ EPHX2 P34913 1/20 0.54

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
SCHEMBL3675840 0.84 SLC5A1 (0.53) SLC5A1SLC5A2NPC1RAB9A
SCHEMBL3676267 0.84 SLC5A2 (0.59) SLC5A1SLC5A2NPC1RAB9A
SCHEMBL13254155 0.84 SLC5A2 (0.54) SLC5A1SLC5A2NPC1RAB9AHPGD
Atigliflozin SCHEMBL13644156 0.81 SLC5A2 (0.66) SLC5A1SLC5A2NPC1RAB9A
Atigliflozin SCHEMBL14981898 0.81 SLC5A2 (0.66) SLC5A1SLC5A2NPC1RAB9A
Atigliflozin SCHEMBL19276485 0.81 SLC5A2 (0.66) SLC5A1SLC5A2NPC1RAB9A
Atigliflozin SCHEMBL873867 0.81 SLC5A2 (0.66) SLC5A1SLC5A2NPC1RAB9A
Atigliflozin SCHEMBL13641405 0.81 SLC5A2 (0.66) SLC5A1SLC5A2NPC1RAB9A
Atigliflozin SCHEMBL874745 0.81 SLC5A2 (0.66) SLC5A1SLC5A2NPC1RAB9A
Atigliflozin SCHEMBL15628877 0.81 SLC5A2 (0.66) SLC5A1SLC5A2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1964844-B1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application SANOFI AVENTIS DEUTSCHLAND (DE) 2010-09-01 — — EP disclosed
EP-1964844-B1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application SANOFI AVENTIS DEUTSCHLAND (DE) 2010-09-01 — — EP disclosed
EP-1964845-B1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application SANOFI AVENTIS DEUTSCHLAND (DE) 2010-08-11 — — EP disclosed
EP-1964845-B1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application SANOFI AVENTIS DEUTSCHLAND (DE) 2010-08-11 — — EP disclosed
EP-1967523-B1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application SANOFI AVENTIS DEUTSCHLAND (DE) 2010-08-11 — — EP disclosed
EP-1967523-B1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application SANOFI AVENTIS DEUTSCHLAND (DE) 2010-08-11 — — EP disclosed
US-7666848-B2 such as 3-(4-Methoxy-phenyl)-1-[3-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-thiophen-2-yl]-propan-1-one; for use as antidiabetics SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-02-23 — — US disclosed
US-7666848-B2 such as 3-(4-Methoxy-phenyl)-1-[3-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-thiophen-2-yl]-propan-1-one; for use as antidiabetics SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-02-23 — — US disclosed
US-7666848-B2 such as 3-(4-Methoxy-phenyl)-1-[3-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-thiophen-2-yl]-propan-1-one; for use as antidiabetics SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-02-23 — — US disclosed
WO-2009138195-A2 USE OF THIOPHENE GLYCOSIDE DERIVATIVES FOR PRODUCING MEDICAMENTS FOR TREATMENT OF HYPERTENSION SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-11-19 — — WO disclosed
EP-1967523-A1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application Sanofi-Aventis Deutschland GmbH (DE) 2008-09-10 — — EP disclosed
EP-1964845-A1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application Sanofi-Aventis Deutschland GmbH (DE) 2008-09-03 — — EP disclosed
EP-1964844-A1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application Sanofi-Aventis Deutschland GmbH (DE) 2008-09-03 — — EP disclosed
EP-1964844-A1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application Sanofi-Aventis Deutschland GmbH (DE) 2008-09-03 — — EP disclosed
EP-1964845-A1 New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application Sanofi-Aventis Deutschland GmbH (DE) 2008-09-03 — — EP disclosed
US-20060293252-A1 Novel Thiophene Glycoside Derivatives, Processes for The Preparation, Medicaments Comprising These Compounds, and The Use Thereof SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-12-28 — — US disclosed
US-7101856-B2 Thiophene glycoside derivatives, processes for the preparation, medicaments comprising these compounds, and the use thereof SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-09-05 — — US disclosed
EP-1523488-A1 NOVEL THIOPHENYLGLYCOSIDE DERIVATIVES, METHODS FOR PRODUCTION THEREOF, MEDICAMENTS COMPRISING SAID COMPOUNDS AND USE THEREOF Aventis Pharma Deutschland GmbH (DE) 2005-04-20 — — EP disclosed
US-20040138143-A1 Novel thiophene glycoside derivatives, processes for the preparation, medicaments comprising these compounds, and the use thereof SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-07-15 — — US disclosed
WO-2004007517-A1 NOVEL THIOPHENYLGLYCOSIDE DERIVATIVES, METHODS FOR PRODUCTION THEREOF, MEDICAMENTS COMPRISING SAID COMPOUNDS AND USE THEREOF AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-01-22 — — 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 (2 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-20040138143-A1 Novel thiophene glycoside derivatives, processes for the preparation, medicaments comprising these compounds, and the use thereof SLC5A1, SLC5A2, UGGT1 SLC5A1 1/4885SLC5A2 2/4885NPC1 1257/4885
US-20060293252-A1 Novel Thiophene Glycoside Derivatives, Processes for The Preparation, Medicaments Comprising These Compounds, and The Use Thereof SLC5A2, SLC5A1, DPP4 SLC5A1 2/4885SLC5A2 1/4885NPC1 1723/4885

“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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