SCHEMBL4678968

SCHEMBL4678968

C=CCOC(=O)[C](C)C

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
SCHEMBL149514 0.85
SCHEMBL29220303 0.85 TSHR (0.44)
SCHEMBL29710697 0.85
SCHEMBL177943 0.84 CYP3A4 (0.48)
SCHEMBL22017 0.83
SCHEMBL1057516 0.83 TSHR (0.50)
SCHEMBL6269152 0.83
SCHEMBL8921614 0.83
SCHEMBL4823985 0.83
SCHEMBL7512684 0.81 CYP3A4 (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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5380852-A Plant safening agents HOECHST AKTIENGESELLSCHAFT (DE) 1995-01-10 US claimed
EP-1095935-B1 6-Hydroxy-5,6-dihydrouracils as herbicides SUMITOMO CHEMICAL CO (JP) 2008-12-17 EP disclosed
EP-1101761-B1 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL CO (JP) 2005-08-17 EP disclosed
CN-1164171-C Aqueous pesticide composition 住友化学工业株式会社 2004-09-01 CN disclosed
EP-1206185-B1 COMBINATIONS CONSISTING OF HERBICIDES AND SAFENERS BAYER CROPSCIENCE GMBH (DE) 2004-02-18 EP disclosed
US-20030216258-A1 Condensed heterocylic compounds and herbicides containing them as active ingredients SUMITOMO CHEMICAL COMPANY, LIMITED 2003-11-20 US disclosed
US-6586368-B1 Benzofuran derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-07-01 US disclosed
US-6410484-B1 ACTIVE MATERIAL; CONTROLLING WEEDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-06-25 US disclosed
US-6403534-B1 HERBICIDES; 1-(2-CHLORO-4-FLUORO-5-(3-METHYL-2,6-DIOXO-4-(TRIFLUOROMETHYL)-1,2,3,6 -TETRAHYDROPYRIMIDIN-1-YL) PHENOXY)CYCLOPROPANECARBOXYLATES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-06-11 US disclosed
EP-1206185-A1 COMBINATIONS CONSISTING OF HERBICIDES AND SAFENERS Aventis CropScience GmbH (DE) 2002-05-22 EP disclosed
EP-1101761-A2 Process for producing 3-phenyluracil compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-23 EP disclosed
EP-1095935-A1 6-Hydroxy-5,6-dihydrouracils as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-02 EP disclosed
WO-2001008487-A1 COMBINATIONS CONSISTING OF HERBICIDES AND SAFENERS AVENTIS CROPSCIENCE GMBH (DE) 2001-02-08 WO disclosed
US-6114286-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-09-05 US disclosed
WO-2000015633-A1 CONDENSED HETEROCYLIC COMPOUNDS AND HERBICIDES CONTAINING THEM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-03-23 WO disclosed
CN-1234399-A Primidinone derivative SUMITOMO CHEM IND (JP) 1999-11-10 CN disclosed
EP-0947516-A1 N-benzyl substituted, heterocyclic ring-fused pyrimidinone derivatives, their preparation and their use as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-10-06 EP disclosed
EP-0492366-B1 New 5-chloroquinolin-8-oxyalkanecarbonic acid derivatives, process for their preparation and their use as antidotes for herbicides HOECHST SCHERING AGREVO GMBH (DE) 1997-03-26 EP disclosed
US-5380852-A Plant safening agents HOECHST AKTIENGESELLSCHAFT (DE) 1995-01-10 US disclosed
EP-0492366-A2 New 5-chloroquinolin-8-oxyalkanecarbonic acid derivatives, process for their preparation and their use as antidotes for herbicides Hoechst Schering AgrEvo GmbH (DE) 1992-07-01 EP disclosed