SCHEMBL4354624

SCHEMBL4354624

CCCNCCOCC

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
SCHEMBL26404332 0.95 KDM4E (0.43)
SCHEMBL25122632 0.95 KDM4E (0.43)
SCHEMBL31151042 0.95 KDM4E (0.43)
SCHEMBL31151160 0.95 KDM4E (0.43)
SCHEMBL239490 0.91 ALDH1A1 (0.45)
Hydrochloric Acid SCHEMBL1965268 0.88 ALDH1A1 (0.43)
SCHEMBL13668379 0.88 TSHR (0.40)
SCHEMBL10962985 0.86 KDM4E (0.47)
SCHEMBL15713284 0.86 TSHR (0.43)
SCHEMBL5933120 0.86 KDM4E (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112968209-A Ionic liquid gel electrolyte and preparation method and application thereof 珠海中科先进技术研究院有限公司 2021-06-15 CN disclosed
EP-3414310-B1 6-DESOXY-6-AMINO-CELLULOSES AS SOIL RELEASE AGENTS HENKEL AG & CO KGAA (DE) 2021-03-31 EP disclosed
US-10577566-B2 6-desoxy-6-amino-celluloses as soil release agents HENKEL AG & CO. KGAA (DE) 2020-03-03 US disclosed
WO-2017137295-A1 6-DESOXY-6-AMINO-CELLULOSES AS SOIL RELEASE AGENTS HENKEL AG & CO. KGAA (DE) 2017-08-17 WO disclosed
US-20170231966-A1 INHIBITION OF IL-2 PRODUCTION AYUMI PHARMACEUTICAL CORPORATION (JP) 2017-08-17 US disclosed
US-9650351-B2 Inhibition of IL-2 production AYUMI PHARMACEUTICAL CORPORATION (JP) 2017-05-16 US disclosed
US-9580404-B2 Substituted azines as pesticides NOVARTIS TIERGESUNDHEIT AG (US) 2017-02-28 US disclosed
WO-2016044641-A2 CARM1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-03-24 WO disclosed
US-20160046591-A1 INHIBITION OF IL-2 PRODUCTION AYUMI PHARMACEUTICAL CORPORATION (JP) 2016-02-18 US disclosed
US-9079917-B2 Oxabicycloheptanes and oxabicycloheptenes, their preparation and use LIXTE BIOTECHNOLOGY, INC. (US) 2015-07-14 US disclosed
US-7112598-B2 κ opioid receptor agonist comprising 2-phenylbenzothiazoline derivative SANTEN PHARMACEUTICAL CO., LTD. (JP) 2006-09-26 US disclosed
US-20060205796-A1 Method for treating pain or pruritis by administering opinoid receptor agonist comprising 2-phenylbenzothiazoling derivative SANTEN PHARMACEUTICAL CO., LTD. (JP) 2006-09-14 US disclosed
US-20050113430-A1 Kappa-opioid receptor agonist comprising 2-phenylbenzothiazoline derivative SANTEN PHARMACEUTICAL CO., LTD (JP) 2005-05-26 US disclosed
EP-1496053-A1 KAPPA-OPIOID RECEPTOR AGONIST COMPRISING 2-PHENYLBENZOTHIAZOLINE DERIVATIVE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2005-01-12 EP disclosed
US-5639770-A SUPEROXIDE INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-06-17 US disclosed
EP-0600092-A1 THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-08 EP disclosed
US-4594176-A Stripping bath ECONOMICS LABORATORY, INC. (US) 1986-06-10 US disclosed
EP-0163383-A1 Aqueous alkaline paint stripping compositions ECOLAB INC. (US) 1985-12-04 EP disclosed
US-4537705-A INCLUDING A POLYOXYALKYLENE POLYAMINE PROMOTER; NONTOXIC; HEAT RESISTANCE ECONOMICS LABORATORY, INC. (US) 1985-08-27 US disclosed
US-4251262-A 1-Carbamoyl-1,2,4-triazole herbicidal agents THE BOOTS COMPANY LIMITED (GB) 1981-02-17 US disclosed