SCHEMBL4018404

SCHEMBL4018404

CCC=C(C=O)CCC

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
SCHEMBL7042762 1.00
SCHEMBL7937719 0.85 LMNA (0.43)
SCHEMBL7937721 0.85 LMNA (0.43)
SCHEMBL11531131 0.83 LMNA (0.50)
SCHEMBL20981809 0.83 LMNA (0.50)
SCHEMBL11531133 0.83 LMNA (0.50)
SCHEMBL7038737 0.82 ALDH1A1 (0.39)
SCHEMBL7038740 0.82 ALDH1A1 (0.39)
SCHEMBL9241296 0.81 TDP1 (0.51)
SCHEMBL1699979 0.81 TDP1 (0.51)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170291866-A1 Production of Mixed Aldol Products from the Products of Hydroformylation Reactions Texmark Chemicals, Inc. (US) 2017-10-12 US claimed
US-9688599-B2 Production of mixed aldol products from the products of hydroformylation reactions Texmark Chemicals, Inc. (US) 2017-06-27 US claimed
US-20150299081-A1 Production of Mixed Aldol Products from the Products of Hydroformylation Reactions Texmark Chemicals, Inc. (US) 2015-10-22 US claimed
WO-2015161321-A1 PRODUCTION OF MIXED ALDOL PRODUCTS FROM THE PRODUCTS OF HYDROFORMYLATION REACTIONS Texmark Chemicals, Inc. (US) 2015-10-22 WO claimed
US-20190241822-A1 COMPOSITION FOR REMOVING IRON SULFIDE KURARAY CO., LTD. (JP) 2019-08-08 US disclosed
EP-3486353-A1 COMPOSITION FOR REMOVING IRON SULFIDE Kuraray Co., Ltd. (JP) 2019-05-22 EP disclosed
US-20170291866-A1 Production of Mixed Aldol Products from the Products of Hydroformylation Reactions Texmark Chemicals, Inc. (US) 2017-10-12 US disclosed
US-9688599-B2 Production of mixed aldol products from the products of hydroformylation reactions Texmark Chemicals, Inc. (US) 2017-06-27 US disclosed
CN-104028311-B A kind of octyl alconyl oxo catalyst chemical regeneration method 天津渤化永利化工股份有限公司 2016-06-15 CN disclosed
US-20150299081-A1 Production of Mixed Aldol Products from the Products of Hydroformylation Reactions Texmark Chemicals, Inc. (US) 2015-10-22 US disclosed
WO-2015161321-A1 PRODUCTION OF MIXED ALDOL PRODUCTS FROM THE PRODUCTS OF HYDROFORMYLATION REACTIONS Texmark Chemicals, Inc. (US) 2015-10-22 WO disclosed
CN-102272079-B Apparatus for producing alcohols from olefins LG CHEMICAL LTD 2015-04-22 CN disclosed
US-5362519-A Polyesters particularly suitable for use in coating compositions which are sprayed with compressed fluids as vicosity reducing agents UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1994-11-08 US disclosed
EP-0545108-A1 Polyesters of branched aliphatic diols UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-06-09 EP disclosed
EP-0545110-A1 Polyesters for coating compositions which are sprayed with compressed fluids as viscosity reducing diluents UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-06-09 EP disclosed
EP-0542220-A1 Polyurethanes and processes for preparing same UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-19 EP disclosed
EP-0542219-A2 Polyurethane (meth)acrylates and processes for preparing same UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-19 EP disclosed
EP-0542218-A1 Conformal coating compositions UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-19 EP disclosed
EP-0542217-A2 Substituted 1,5-pentanediols and processes for the preparation thereof UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-19 EP disclosed
US-4317925-A Process for the production of di-n-propylacetic acid RUHRCHEMIE AKTIENGESELLSCHAFT (DE) 1982-03-02 US disclosed