SCHEMBL2401864

SCHEMBL2401864

CCCC(O)O[Ti](=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
SCHEMBL7184750 0.73 TSHR (0.31)
SCHEMBL3281118 0.68 TSHR (0.40)
SCHEMBL2121872 0.68 TSHR (0.56)
SCHEMBL8406999 0.67
SCHEMBL23985 0.66
SCHEMBL11880055 0.66
SCHEMBL13616194 0.66
SCHEMBL8472259 0.65 CHRM1 (0.40)
SCHEMBL12518006 0.64
SCHEMBL9093559 0.64 TSHR (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016126757-A1 METHODS FOR PREPARATION OF MACROCYCLIC POLYESTER OLIGOMER FROM LINEAR POLYESTER LIQUID THERMO PLASTICS, INC. (US) 2016-08-11 WO disclosed
EP-2678371-B1 METHODS FOR PREPARATION OF MACROCYCLIC POLYESTER OLIGOMER VIA HETEROGENEOUS CATALYSIS CYCLICS CORP (US) 2015-01-07 EP disclosed
US-20140378644-A1 METHODS FOR PREPARATION OF MACROCYCLIC POLYESTER OLIGOMER VIA HETEROGENEOUS CATALYSIS LIQUID THERMO PLASTICS INC (US) 2014-12-25 US disclosed
US-8829152-B2 Methods for preparation of macrocyclic polyester oligomer via heterogeneous catalysis LIQUID THERMO PLASTICS, INC. (US) 2014-09-09 US disclosed
US-20120302721-A1 Methods for Preparation of Macrocyclic Polyester Oligomer via Heterogeneous Catalysis LIQUID THERMO PLASTICS, INC. 2012-11-29 US disclosed
WO-2012145065-A1 METHODS FOR PREPARATION OF MACROCYCLIC POLYESTER OLIGOMER VIA HETEROGENEOUS CATALYSIS CYCLICS CORPORATION (US) 2012-10-26 WO disclosed
US-8283437-B2 Preparation of low-acid polyalkylene terephthalate and preparation of macrocyclic polyester oligomer therefrom CYCLICS CORPORATION (US) 2012-10-09 US disclosed
US-20110213116-A1 PREPARATION OF LOW-ACID POLYALKYLENE TEREPHTHALATE AND PREPARATION OF MACROCYCLIC POLYESTER OLIGOMER THEREFROM LIQUID THERMO PLASTICS, INC. 2011-09-01 US disclosed
US-7767781-B2 Preparation of low-acid polyalkylene terephthalate and preparation of macrocyclic polyester oligomer therefrom CYCLICS CORPORATION (US) 2010-08-03 US disclosed
US-7750109-B2 Use of a residual oligomer recyclate in the production of macrocyclic polyester oligomer CYCLICS CORPORATION (US) 2010-07-06 US disclosed
US-7732557-B2 Methods for removing catalyst residue from a depolymerization process stream CYCLICS CORPORATION (US) 2010-06-08 US disclosed
EP-1879940-A1 PREPARATION OF LOW-ACID POLYALKYLENE TEREPHTHALATE AND PREPARATION OF MACROCYCLIC POLYESTER OLIGOMER THEREFROM Cyclics Corporation (US) 2008-01-23 EP disclosed
US-20060235233-A1 Methods for removing catalyst residue from a depolymerization process stream CYCLICS CORPORATION (US) 2006-10-19 US disclosed
US-20060235186-A1 Use of a residual oligomer recyclate in the production of macrocyclic polyester oligomer CYCLICS CORPORATION (US) 2006-10-19 US disclosed
US-20060235185-A1 Preparation of low-acid polyalkylene terephthalate and preparation of macrocyclic polyester oligomer therefrom CYCLICS CORPORATION (US) 2006-10-19 US disclosed
WO-2006104821-A1 PREPARATION OF LOW-ACID POLYALKYLENE TEREPHTHALATE AND PREPARATION OF MACROCYCLIC POLYESTER OLIGOMER THEREFROM CYCLICS CORPORAITON (US) 2006-10-05 WO disclosed