SCHEMBL317604

SCHEMBL317604

CCC(CC)(C(C)=O)C(=O)O.O=[Ti](O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
THRB P10828 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL1157607 0.90 ALDH1A1 (0.35) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL1681817 0.87 ALDH1A1 (0.33) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL28900863 0.87 ALDH1A1 (0.33) MEN1ALDH1A1CYP1A2THRBKMT2A
Acetic Acid SCHEMBL8992542 0.87 FFAR3 (0.39) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL610850 0.87 ALDH1A1 (0.33) MEN1ALDH1A1CYP1A2THRBKMT2A
Acetic Acid SCHEMBL28559169 0.85 FFAR3 (0.37) MEN1ALDH1A1CYP1A2THRBKMT2A
Isopropyl Alcohol SCHEMBL9453194 0.79 TP53 (0.32)
Isopropyl Alcohol SCHEMBL1305057 0.79 TP53 (0.32)
Isopropyl Alcohol SCHEMBL9765265 0.79 TP53 (0.32)
Isopropyl Alcohol SCHEMBL1720333 0.79 TP53 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240166808-A1 Catalyst Composition For A Polyester Manufacturing Process CLARIANT INTERNATIONAL LTD (CH) 2024-05-23 US claimed
US-8092736-B2 Fluorotelomer/silane compositions E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-01-10 US claimed
US-20100127426-A1 FLUOROTELOMER/SILANE COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY 2010-05-27 US claimed
US-20240166808-A1 Catalyst Composition For A Polyester Manufacturing Process CLARIANT INTERNATIONAL LTD (CH) 2024-05-23 US disclosed
US-20210214491-A1 CATALYST COMPOSITION FOR A POLYESTER MANUFACTURING PROCESS CLARIANT PLASTICS & COATINGS LTD (CH) 2021-07-15 US disclosed
US-10982045-B2 Catalyst composition for a polyester manufacturing process CLARIANT PLASTICS & COATINGS LTD (CH) 2021-04-20 US disclosed
EP-3000835-B1 CATALYST COMPOSITION FOR A POLYESTER MANUFACTURING PROCESS CLARIANT INT LTD (CH) 2020-11-25 EP disclosed
EP-3197934-B1 CATALYST COMPOSITION FOR A POLYESTER MANUFACTURING PROCESS CLARIANT PLASTICS & COATINGS LTD (CH) 2019-11-06 EP disclosed
US-20170283549-A1 Catalyst Composition For A Polyester Manufacturing Process CLARIANT PLASTICS & COATINGS LTD (CH) 2017-10-05 US disclosed
EP-3197934-A1 CATALYST COMPOSITION FOR A POLYESTER MANUFACTURING PROCESS Clariant Plastics & Coatings Ltd (CH) 2017-08-02 EP disclosed
WO-2016045923-A1 CATALYST COMPOSITION FOR A POLYESTER MANUFACTURING PROCESS CLARIANT INTERNATIONAL LTD (CH) 2016-03-31 WO disclosed
EP-1740596-B1 ALKOXYLATED PHOSPHITE ESTER AND PROCESS THEREFOR DU PONT (US) 2007-09-26 EP disclosed
US-20070010393-A1 Alkoxylated phosphite ester and process therefor PUTZIG DONALD E 2007-01-11 US disclosed
EP-1740596-A1 ALKOXYLATED PHOSPHITE ESTER AND PROCESS THEREFOR E.I.Du pont de nemours and company (US) 2007-01-10 EP disclosed
US-7138356-B2 Alkoxylated phosphite ester and process therefor E. I. DU PONT DE NEMOURS AND COMPANY (US) 2006-11-21 US disclosed
WO-2005097810-A1 ALKOXYLATED PHOSPHITE ESTER AND PROCESS THEREFOR E.I. DUPONT DE NEMOURS AND COMPANY (US) 2005-10-20 WO disclosed
WO-2005097321-A1 ESTERIFICATION CATALYST AND PROCESS THEREWITH E.I. DUPONT DE NEMOURS AND COMPANY (US) 2005-10-20 WO disclosed
US-20050215809-A1 Tris(hydroxyalkyl) or tris(hydroxypolyalkyleneoxy) phosphite that may contain an organotitanium compound such as tetraalkyl titanate or titanium bis-ammonium lactate and hypophosphorous acid or its salt; used in the preparation of polyesters to reduce discoloration E. I. DU PONT DE NEMOURS AND COMPANY 2005-09-29 US disclosed
US-20050215425-A1 Esterification catalyst and process therewith E. I. DU PONT DE NEMOURS AND COMPANY 2005-09-29 US disclosed
US-20050215426-A1 Esterification catalyst and process therewith E. I. DU PONT DE NEMOURS AND COMPANY 2005-09-29 US disclosed