SCHEMBL9168802

SCHEMBL9168802

COC(OC)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
SCHEMBL18815292 0.71 ALDH1A1 (0.35)
SCHEMBL9336628 0.69
SCHEMBL3252658 0.69 ALDH1A1 (0.33)
SCHEMBL7003107 0.69 TSHR (0.35)
SCHEMBL14752945 0.69
SCHEMBL19690703 0.69
SCHEMBL8847344 0.69
SCHEMBL1076168 0.69
SCHEMBL13046722 0.69
SCHEMBL12233180 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025129104-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF SIONNA THERAPEUTICS INC. (US) 2025-06-19 WO disclosed
US-9951165-B2 Cationizable rheology modifying and setting means, composition thereof and method of making both BASF SE (DE) 2018-04-24 US disclosed
EP-2925799-B1 CATIONIZABLE RHEOLOGY MODIFYING AND SETTING MEANS, COMPOSITION THEREOF AND METHOD OF MAKING BOTH BASF SE (DE) 2016-09-28 EP disclosed
US-20150315323-A1 Cationizable Rheology Modifying And Setting Means, Composition Thereof And Method Of Making Both BASF SE (DE) 2015-11-05 US disclosed
EP-2925799-A1 CATIONIZABLE RHEOLOGY MODIFYING AND SETTING MEANS, COMPOSITION THEREOF AND METHOD OF MAKING BOTH BASF SE (DE) 2015-10-07 EP disclosed
WO-2014082904-A1 CATIONIZABLE RHEOLOGY MODIFYING AND SETTING MEANS, COMPOSITION THEREOF AND METHOD OF MAKING BOTH BASF SE (DE) 2014-06-05 WO disclosed
EP-0460451-B1 Process for the preparation of alpha-hydroxymethyl-ketals BASF AG (DE) 1995-05-10 EP disclosed
EP-0173026-B1 PROCESS FOR THE PREPARATION OF ALKYL ETHERS AND ENOL ETHERS OF ACETOINS HÜLS AKTIENGESELLSCHAFT (DE) 1988-10-12 EP disclosed
EP-0173026-A2 Process for the preparation of alkyl ethers and enol ethers of acetoins HÜLS AKTIENGESELLSCHAFT (DE) 1986-03-05 EP disclosed
EP-0079432-B1 PROCESS FOR THE PRODUCTION OF METHACRYLIC ACID FROM ISOBUTYRALDEHYDE HÜLS AKTIENGESELLSCHAFT (DE) 1984-10-24 EP disclosed
US-4469887-A MULTISTAGE CHEMISCHE WERKE HUELS, AG (DE) 1984-09-04 US disclosed
EP-0079432-A1 Process for the production of methacrylic acid from isobutyraldehyde HÜLS AKTIENGESELLSCHAFT (DE) 1983-05-25 EP disclosed