SCHEMBL95055

SCHEMBL95055

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
SCHEMBL4894392 1.00
SCHEMBL1732517 0.80
SCHEMBL263999 0.80
SCHEMBL1732572 0.80
SCHEMBL12640198 0.79 ALDH1A1 (0.53)
SCHEMBL141446 0.79 ALDH1A1 (0.53)
SCHEMBL80284 0.79
SCHEMBL19318891 0.79 ALDH1A1 (0.53)
SCHEMBL5394103 0.79 ALDH1A1 (0.53)
SCHEMBL17434636 0.78 ALDH1A1 (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 649 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9487494-B2 Cyclic hydrocarbon compounds for the treatment of diseases LEO PHARMA A/S (DK) 2016-11-08 US claimed
US-20100317582-A1 NOVEL CYCLIC HYDROCARBON COMPOUNDS FOR THE TREATMENT OF DISEASES LEO PHARMA A/S (DK) 2010-12-16 US claimed
EP-2234961-A2 NOVEL CYCLIC HYDROCARBON COMPOUNDS FOR THE TREATMENT OF DISEASES LEO PHARMA A/S (DK) 2010-10-06 EP claimed
WO-2009065406-A2 NOVEL CYCLIC HYDROCARBON COMPOUNDS FOR THE TREATMENT OF DISEASES LEO PHARMA A/S (DK) 2009-05-28 WO claimed
US-7521396-B2 Substituted (thioxo)carbonylaminophenyluracils BAYER CROPSCIENCE AG (DE) 2009-04-21 US claimed
US-20060089262-A1 Substituted (thioxo)carbonylamino phenyl uraciles BAYER CROPSCIENCE AG (DE) 2006-04-27 US claimed
US-6992044-B1 Substituted phenyluracils BAYER CROPSCIENCE AG (DE) 2006-01-31 US claimed
EP-1503994-A1 SUBSTITUTED (THIOXO)CARBONYLAMINO PHENYL URACILES Bayer CropScience AG (DE) 2005-02-09 EP claimed
WO-2003093244-A1 SUBSTITUTED (THIOXO)CARBONYLAMINO PHENYL URACILES BAYER CROPSCIENCE AG (DE) 2003-11-13 WO claimed
EP-1330443-A1 SUBSTITUTED PHENYLURACILS Bayer CropScience AG (DE) 2003-07-30 EP claimed
EP-0267378-A2 Tropolone derivatives as an anti-mycoplasma agent SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI &amp; CO. LTD. (JP) 1988-05-18 EP claimed
US-4649142-A 3,4-dihydro-1,3-disubstituted-6-(substituted phenylimino)-2(1H)-pyrimidinone useful as cardiotonic agent and anti-allergic agent FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-03-10 US claimed
EP-0210474-A1 Substituted 3-amino-sydnone imines, method for their preparation, their use and pharmaceutical compositions containing these compounds CASSELLA Aktiengesellschaft (DE) 1987-02-04 EP claimed
EP-0094641-B1 DIPHENYL SULFONE COMPOUNDS, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-09-10 EP claimed
US-4565569-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-01-21 US claimed
US-4545812-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-10-08 US claimed
EP-0094641-A2 Diphenyl sulfone compounds, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-11-23 EP claimed
US-4352800-A ANTIBIOTICS, BLOOD KYOTO YAKUHIN KYOGO KABUSHIKI KAISHA (JP) 1982-10-05 US claimed
US-4277465-A ENAMINE DERIVATIVE KYOTO YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 1981-07-07 US claimed
EP-0009609-A2 Adjuvant for promoting absorption of therapeutically active substances through the digestive tract, pharmaceutical composition comprising said adjuvant and process for preparing said pharmaceutical composition; enamine derivatives KYOTO YAKUHIN KOGYO KABUSHIKI KAISHA (JP) 1980-04-16 EP claimed