SCHEMBL5065489

SCHEMBL5065489

CCCCC(CO)SC

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
SCHEMBL15150999 0.91 LMNA (0.54)
SCHEMBL15068203 0.78 ALDH1A1 (0.44)
SCHEMBL9486997 0.77 DNM1 (0.36)
SCHEMBL386415 0.75
SCHEMBL10816972 0.75
SCHEMBL8097347 0.75 ALDH1A1 (0.41)
SCHEMBL1849005 0.74
SCHEMBL24658493 0.74 TSHR (0.44)
SCHEMBL2892603 0.74 TSHR (0.44)
SCHEMBL20054079 0.74 TSHR (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080081343-A1 Differential labeling for quantitative analysis of complex protein mixtures SYNGENTA PARTICIPATIONS AG (CH) 2008-04-03 US disclosed
US-7166436-B2 Differential labeling for quantitative analysis of complex protein mixtures SYNGENTA PARTICIPATIONS, AG (CH) 2007-01-23 US disclosed
EP-1428019-A4 SYSTEM AND METHOD OF DETERMINING PROTEOMIC DIFFERENCES SYNGENTA PARTICIPATIONS AG (CH) 2006-04-26 EP disclosed
US-20060004525-A1 System and method of determining proteomic differences SYNGENTA PARTICIPATIONS AG 2006-01-05 US disclosed
US-6969757-B2 Differential labeling for quantitative analysis of complex protein mixtures SYNGENTA PARTICIPATIONS AG (CH) 2005-11-29 US disclosed
EP-1525483-A2 DIFFERENTIAL LABELING FOR QUANTITATIVE ANALYSIS OF COMPLEX PROTEIN MIXTURES BY TRIFUNCTIONAL SYNTHETIC PEPTIDE BASED REAGENTS WITH IODACETAMIDO GROUPS Syngenta Participations AG (CH) 2005-04-27 EP disclosed
WO-2002059144-A9 DIFFERENTIAL LABELING FOR QUANTITATIVE ANALYSIS OF COMPLEX PROTEIN MIXTURES SYNGENTA PARTICIPATIONS AG (US) 2004-08-12 WO disclosed
EP-1428019-A2 SYSTEM AND METHOD OF DETERMINING PROTEOMIC DIFFERENCES Syngenta Participations AG (CH) 2004-06-16 EP disclosed
WO-2003006951-A9 SYSTEM AND METHOD OF DETERMINING PROTEOMIC DIFFERENCES SYNGENTA PARTICIPATIONS AG (CH) 2004-05-13 WO disclosed
WO-2004013636-A2 DIFFERENTIAL LABELING FOR QUANTITATIVE ANALYSIS OF COMPLEX PROTEIN MIXTURES BY TRIFUNCTIONAL SYNTHETIC PEPTIDE BASED REAGENTS WITH IODOACETAMIDO GROUPS SYNGENTA PARTICIPATIONS AG (CH) 2004-02-12 WO disclosed
US-20030087329-A1 Differential labeling for quantitative analysis of complex protein mixtures SYNGENTA PARTICIPATIONS AG (CH) 2003-05-08 US disclosed
US-20030082522-A1 Differential labeling for quantitative analysis of complex protein mixtures SYNGENTA PARTICIPATIONS AG (CH) 2003-05-01 US disclosed
US-20030068825-A1 System and method of determining proteomic differences SYNGENTA PARTICIPATIONS AG (CH) 2003-04-10 US disclosed
WO-2003006951-A2 SYSTEM AND METHOD OF DETERMINING PROTEOMIC DIFFERENCES SYNGENTA PARTICIPATIONS AG (CH) 2003-01-23 WO disclosed
WO-2002059144-A2 DIFFERENTIAL LABELING FOR QUANTITATIVE ANALYSIS OF COMPLEX PROTEIN MIXTURES SYNGENTA PARTICIPATION AG (US) 2002-08-01 WO disclosed