SCHEMBL4902592

SCHEMBL4902592

C=CC(=O)CC(C)CC

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
SCHEMBL3762565 0.87 TSHR (0.50)
SCHEMBL6764363 0.82 TSHR (0.46)
SCHEMBL23728365 0.79
SCHEMBL28637833 0.79 TSHR (0.42)
SCHEMBL6762053 0.78 TSHR (0.52)
SCHEMBL4822272 0.78
SCHEMBL4903718 0.77 TSHR (0.46)
SCHEMBL98033 0.77
SCHEMBL9846582 0.76
SCHEMBL28093228 0.76 TSHR (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5004845-A Producing alcohol DAVY MCKEE (LONDON) LIMITED (GB) 1991-04-02 US claimed
EP-0074193-B1 CATALYTIC HYDROGENATION DAVY McKEE (LONDON) LIMITED (GB) 1986-10-29 EP claimed
EP-0073129-B1 HYDROGENATION PROCESS DAVY McKEE (LONDON) LIMITED (GB) 1985-06-19 EP claimed
US-4451677-A VAPOR PHASE CATALYSIS DAVY MCKEE (LONDON) LIMITED (GB) 1984-05-29 US claimed
EP-0074193-A1 Catalytic hydrogenation DAVY McKEE (LONDON) LIMITED (GB) 1983-03-16 EP claimed
EP-0073129-A1 Hydrogenation process DAVY McKEE (LONDON) LIMITED (GB) 1983-03-02 EP claimed
US-12343693-B2 Static mixers for continuous flow catalytic reactors COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2025-07-01 US disclosed
EP-3393643-B1 STATIC MIXERS FOR CONTINUOUS FLOW CATALYTIC REACTORS COMMW SCIENT IND RES ORG (AU) 2024-01-31 EP disclosed
US-11541412-B2 Static mixers for continuous flow catalytic reactors COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2023-01-03 US disclosed
US-20220258110-A1 STATIC MIXERS FOR CONTINUOUS FLOW CATALYTIC REACTORS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2022-08-18 US disclosed
CN-108430221-B Herbicidal composition 美国陶氏益农公司 2022-04-19 CN disclosed
CN-105189426-B Integrated process for the simultaneous production of oxo-alcohols and plasticizers 沙特基础工业公司 2020-09-18 CN disclosed
EP-3393643-A1 STATIC MIXERS FOR CONTINUOUS FLOW CATALYTIC REACTORS Commonwealth Scientific and Industrial Research Organisation (AU) 2018-10-31 EP disclosed
EP-0073129-B1 HYDROGENATION PROCESS DAVY McKEE (LONDON) LIMITED (GB) 1985-06-19 EP disclosed
US-4451677-A VAPOR PHASE CATALYSIS DAVY MCKEE (LONDON) LIMITED (GB) 1984-05-29 US disclosed
EP-0097891-A1 A method for refining crude aldehyde products UNION CARBIDE CORPORATION (US) 1984-01-11 EP disclosed
EP-0074193-A1 Catalytic hydrogenation DAVY McKEE (LONDON) LIMITED (GB) 1983-03-16 EP disclosed
EP-0073129-A1 Hydrogenation process DAVY McKEE (LONDON) LIMITED (GB) 1983-03-02 EP disclosed
US-4182873-A AMINATION OF MERCAPTO THIAZOLE OR DISULFIDE RHONE-POULENC S.A. (FR) 1980-01-08 US disclosed
US-4182873-A AMINATION OF MERCAPTO THIAZOLE OR DISULFIDE RHONE-POULENC S.A. (FR) 1980-01-08 US disclosed