SCHEMBL968722

SCHEMBL968722

[O]CSC(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL3771818 0.72 TSHR (0.39)
SCHEMBL968723 0.69
SCHEMBL7790194 0.67
SCHEMBL4405064 0.65 HSD17B10 (0.37)
SCHEMBL3085542 0.65 TDP1 (0.45)
SCHEMBL756107 0.62
SCHEMBL95391 0.56
SCHEMBL8180839 0.56
Ammonia Solution, Strong SCHEMBL9146129 0.53 CA1 (0.36)
SCHEMBL30104 0.52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8314217-B2 Cross-linked glycopeptide-cephalosporin antibiotics THERAVANCE, INC. (US) 2012-11-20 US disclosed
US-20110224130-A1 CROSS-LINKED GLYCOPEPTIDE-CEPHALOSPORIN ANTIBIOTICS THERAVANCE, INC. (US) 2011-09-15 US disclosed
US-7871997-B2 Cephalosporin compounds THERAVANCE, INC. (US) 2011-01-18 US disclosed
EP-1633759-B1 CROSS-LINKED GLYCOPEPTIDE-CEPHALOSPORIN ANTIBIOTICS THERAVANCE INC (US) 2009-12-02 EP disclosed
US-20080103299-A1 Cross-linked glycopeptide - cephalosporin antibiotics THERAVANCE BIOPHARMA ANTIBIOTICS IP, LLC 2008-05-01 US disclosed
EP-1644382-B1 CROSS-LINKED GLYCOPEPTIDE-CEPHALOSPORIN ANTIBIOTICS THERAVANCE INC (US) 2008-03-05 EP disclosed
US-7332471-B2 Cross-linked glycopeptide-cephalosporin antibiotics THERAVANCE, INC. (US) 2008-02-19 US disclosed
US-7279458-B2 Cross-linked glycopeptide-cephalosporin antibiotics THERAVANCE, INC. (US) 2007-10-09 US disclosed
US-20060189517-A1 Cross-linked glycopeptide-cephalosporin antibiotics THERAVANCE BIOPHARMA ANTIBIOTICS IP, LLC 2006-08-24 US disclosed
US-7067481-B2 Cross-linked glycopeptide-cephalosporin antibiotics THERAVANCE, INC. (US) 2006-06-27 US disclosed
US-7067482-B2 Cross-linked glycopeptide-cephalosporin antibiotics THERAVANCE, INC. (US) 2006-06-27 US disclosed
US-20060128612-A1 Cross-linked glycopeptide-cephalosporin antibiotics THERAVANCE BIOPHARMA ANTIBIOTICS IP, LLC 2006-06-15 US disclosed
EP-1644382-A2 CROSS-LINKED GLYCOPEPTIDE-CEPHALOSPORIN ANTIBIOTICS Theravance, Inc. (US) 2006-04-12 EP disclosed
EP-1633759-A1 CROSS-LINKED GLYCOPEPTIDE - CEPHALOSPORIN ANTIBIOTICS Theravance, Inc. (US) 2006-03-15 EP disclosed
US-20050026818-A1 Cross-linked glycopeptide-cephalosporin antibiotics THERAVANCE BIOPHARMA ANTIBIOTICS IP, LLC 2005-02-03 US disclosed
WO-2005005436-A2 CROSS-LINKED GLYCOPEPTIDE-CEPHALOSPORIN ANTIBIOTICS THERAVANCE, INC. (US) 2005-01-20 WO disclosed
US-20040266666-A1 Cross-linked glycopeptide-cephalosporin antibiotics THERAVANCE BIOPHARMA ANTIBIOTICS IP, LLC 2004-12-30 US disclosed
WO-2004113350-A1 CROSS-LINKED GLYCOPEPTIDE - CEPHALOSPORIN ANTIBIOTICS THERAVANCE, INC. (US) 2004-12-29 WO disclosed