SCHEMBL13254155

SCHEMBL13254155

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

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC5A2 P31639 8/20 0.54
▸ SLC5A1 P13866 7/20 0.54
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ ACHE P22303 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SNCA P37840 1/20 0.46

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
SCHEMBL13088381 0.92 SLC5A1 (0.45) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL3684207 0.89 SLC5A2 (0.47) SLC5A2SLC5A1
SCHEMBL3673113 0.84 SLC5A1 (0.66) SLC5A2SLC5A1NPC1RAB9AHPGD
SCHEMBL3675840 0.83 SLC5A1 (0.53) SLC5A2SLC5A1NPC1RAB9AACHE
SCHEMBL12808186 0.82 PPARA (0.40) SLC5A2SLC5A1ALDH1A1HPGD
Atigliflozin SCHEMBL13644156 0.79 SLC5A2 (0.66) SLC5A2SLC5A1NPC1RAB9AACHE
Atigliflozin SCHEMBL14981898 0.79 SLC5A2 (0.66) SLC5A2SLC5A1NPC1RAB9AACHE
Atigliflozin SCHEMBL13641405 0.79 SLC5A2 (0.66) SLC5A2SLC5A1NPC1RAB9AACHE
Atigliflozin SCHEMBL874745 0.79 SLC5A2 (0.66) SLC5A2SLC5A1NPC1RAB9AACHE
Atigliflozin SCHEMBL19276485 0.79 SLC5A2 (0.66) SLC5A2SLC5A1NPC1RAB9AACHE

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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-1523488-B1 NOVEL THIOPHENYLGLYCOSIDE DERIVATIVES, METHODS FOR PRODUCTION THEREOF, MEDICAMENTS COMPRISING SAID COMPOUNDS AND USE THEREOF SANOFI AVENTIS DEUTSCHLAND (DE) 2008-11-12 — — EP 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
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