SCHEMBL82646

SCHEMBL82646

CCOC(=O)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
SCHEMBL11419005 0.81 GAA (0.57)
SCHEMBL2944114 0.81 GAA (0.57)
SCHEMBL2375796 0.80
SCHEMBL8529797 0.79
SCHEMBL1140911 0.79
SCHEMBL2395485 0.77 GAA (0.52)
SCHEMBL70685 0.77
SCHEMBL5517685 0.77
SCHEMBL7377633 0.77
SCHEMBL3296953 0.77 GAA (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4399212-A1 SUBSTITUTED 2,3-DIHYDRO[1,3]THIAZOLO[4,5-B]PYRIDINES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2024-07-17 EP claimed
CN-118159542-A Substituted 2, 3-dihydro [1,3] thiazolo [4,5-b ] pyridines, salts thereof and their use as herbicidal agents 拜耳公司 2024-06-07 CN claimed
WO-2023036707-A1 SUBSTITUTED 2,3-DIHYDRO[1,3]THIAZOLO[4,5-B]PYRIDINES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2023-03-16 WO claimed
EP-3063228-B1 DISPERSE DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIB GMBH (DE) 2020-04-01 EP claimed
US-9567464-B2 Disperse dyes, their preparation and their use DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2017-02-14 US claimed
US-20160280922-A1 DISPERSE DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2016-09-29 US claimed
EP-3063228-A2 DISPERSE DYES, THEIR PREPARATION AND THEIR USE DyStar Colours Distribution GmbH (DE) 2016-09-07 EP claimed
WO-2015062937-A2 DISPERSE DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2015-05-07 WO claimed
EP-2868702-A1 Disperse dyes, their preparation and their use DyStar Colours Distribution GmbH (DE) 2015-05-06 EP claimed
EP-2643000-A2 THERAPEUTIC PIPERAZINES Dart Neuroscience (Cayman) Ltd (KY) 2013-10-02 EP claimed
WO-2003097609-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-11-27 WO claimed
US-5919793-A QUINUCLIDINE DERIVATIVES, SQUALENE SYNTHETASE INHIBITORS, ANTICHOLESTEROL AGENTS ZENECA LIMITED (GB) 1999-07-06 US claimed
CN-1121718-A Heterocyclic derivatives ZENECA LTD (GB) 1996-05-01 CN claimed
EP-0696284-A1 HETEROCYCLIC DERIVATIVES ZENECA LIMITED (GB) 1996-02-14 EP claimed
WO-1994025459-A1 HETEROCYCLIC DERIVATIVES ZENECA LIMITED (GB) 1994-11-10 WO claimed
EP-0133349-B1 HERBICIDAL CYCLOHEXANE-1,3-DIONE DERIVATIVES ICI AUSTRALIA LIMITED (AU) 1988-09-21 EP claimed
US-4711898-A 4-quinolone derivatives having anti-inflammatory, anti-allergic, antitussive, expectorant and antithrombotic activity NIPPON SHINYAKU CO., LTD. (JP) 1987-12-08 US claimed
US-4652303-A Herbicidal 5-(acylphenyl)cyclohexane-1,3-dione derivatives ICI AUSTRALIA LIMITED (AU) 1987-03-24 US claimed
EP-0133349-A1 Herbicidal cyclohexane-1,3-dione derivatives ICI AUSTRALIA LIMITED (AU) 1985-02-20 EP claimed
EP-0008249-A2 Fluorene and fluoranthene derivatives, process for their preparation and their therapeutic application SYNTHELABO (FR) 1980-02-20 EP claimed