SCHEMBL1189342

SCHEMBL1189342

CCC(O)C(C)C=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
SCHEMBL5840288 1.00
SCHEMBL4014096 1.00
SCHEMBL8890971 1.00
SCHEMBL20088936 0.82 TSHR (0.35)
SCHEMBL18160120 0.82 TSHR (0.35)
SCHEMBL20088929 0.82 TSHR (0.35)
SCHEMBL1784659 0.80 PTPN1 (0.39)
SCHEMBL5499760 0.80 TSHR (0.33)
SCHEMBL5494816 0.80 TSHR (0.33)
SCHEMBL13176735 0.80 TSHR (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2951141-B1 PROCESS FOR PRODUCING POLYOLS EASTMAN CHEM CO (US) 2019-06-19 EP claimed
EP-2951144-B1 PREPARATION OF HYDROXY ALDEHYDES EASTMAN CHEM CO (US) 2017-07-05 EP claimed
US-20150368171-A1 PROCESS FOR PRODUCING POLYOLS EASTMAN CHEMICAL COMPANY (US) 2015-12-24 US claimed
EP-2951141-A1 PROCESS FOR PRODUCING POLYOLS Eastman Chemical Company (US) 2015-12-09 EP claimed
EP-2951144-A1 PREPARATION OF HYDROXY ALDEHYDES Eastman Chemical Company (US) 2015-12-09 EP claimed
CN-105073702-A Preparation of hydroxy aldehydes EASTMAN CHEM CO 2015-11-18 CN claimed
CN-105008317-A Process for preparing polyols EASTMAN CHEM CO 2015-10-28 CN claimed
US-9056824-B2 Preparation of hydroxy aldehydes EASTMAN CHEMICAL COMPANY (US) 2015-06-16 US claimed
WO-2014120480-A1 PREPARATION OF HYDROXY ALDEHYDES EASTMAN CHEMICAL COMPANY (US) 2014-08-07 WO claimed
WO-2014120481-A1 PROCESS FOR PRODUCING POLYOLS EASTMAN CHEMICAL COMPANY (US) 2014-08-07 WO claimed
US-20140213827-A1 PREPARATION OF HYDROXY ALDEHYDES EASTMAN CHEMICAL COMPANY (US) 2014-07-31 US claimed
US-8710278-B1 Process for producing polyols EASTMAN CHEMICAL COMPANY (US) 2014-04-29 US claimed
WO-1997016401-A1 REACTION MIXTURES CONTAINING SUBSTITUTED HYDROCARBON DIOLS AND PROCESSES FOR THE PREPARATION THEREOF UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-05-09 WO claimed
CN-112028758-B Process for preparing hydroxyaldehydes and process for resolution of optical isomers using electrodialysis technique 广安摩珈生物科技有限公司 2024-09-10 CN disclosed
WO-2023288257-A2 BIOCATALYTIC COUPLING REACTIONS TOWARD REGIOSELECTIVELY ENRICHED SUBSTITUTED PYRAZINES CONAGEN INC. (US) 2023-01-19 WO disclosed
CN-112028758-A Process for the preparation of hydroxyaldehydes and process for resolving optical isomers using electrodialysis techniques 广安摩珈生物科技有限公司 2020-12-04 CN disclosed
US-4393207-A BAKING FINISHES, ACID-HARDENING COATINGS BASF AKTIENGESELLSCHAFT (DE) 1983-07-12 US disclosed
EP-0043462-A2 Alkoxyalkyl-aminotriazine-transetherifying products and their use BASF Aktiengesellschaft (DE) 1982-01-13 EP disclosed
US-4292198-A FOR HYDROFORMYLATION STAMICARBON, B.V. (NL) 1981-09-29 US disclosed
EP-0021460-A1 Heterogeneous hydroformylation catalyst on the basis of an organometallic complex, and use STAMICARBON B.V. (NL) 1981-01-07 EP disclosed