SCHEMBL728127

SCHEMBL728127

OCC1CCCS1

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
SCHEMBL12671786 1.00
SCHEMBL7430990 0.92
SCHEMBL2733548 0.85
SCHEMBL14915587 0.79
SCHEMBL11960217 0.72
SCHEMBL6599845 0.72
SCHEMBL812832 0.72
SCHEMBL22721435 0.72
SCHEMBL13840787 0.72
SCHEMBL10891089 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4707934-B2 2011-06-22 JP claimed
JP-4708349-B2 2011-06-22 JP claimed
US-6844294-B2 Synergistic herbicidal compositions comprising herbicides from the benzoylcyclohexanedione group for use in rice crops AVENTIS CROPSCIENCE GMBH 2005-01-18 US claimed
WO-2004105482-A2 HERBICIDAL COMPOSITIONS FOR PADDY FIELD BAYER CROPSCIENCE AG (DE) 2004-12-09 WO claimed
US-6809064-B2 PLANT SAFENING AGENTS; BIOCOMPATABILITY AVENTIS CROPSCIENCE GMBH (DE) 2004-10-26 US claimed
EP-1385378-A2 SYNERGISTIC HERBICIDAL AGENT COMPRISING HERBICIDES FROM THE BENZOYLCYCLOHEXANEDIONE GROUP FOR APPLICATION IN RICE CULTIVATION Bayer CropScience GmbH (DE) 2004-02-04 EP claimed
EP-1383381-A1 SYNERGISTIC HERBICIDE COMPRISING BENZOYLCYCLOHEXANEDIONES FOR APPLICATION IN RICE CULTIVATION Bayer CropScience GmbH (DE) 2004-01-28 EP claimed
US-20030104940-A1 Synergistic herbicidal compositions comprising herbicides from the benzoylcyclohexanedione group for use in rice crops AVENTIS CROPSCIENCE GMBH (DE) 2003-06-05 US claimed
US-20030104941-A1 Synergistic herbicidal compositions comprising herbicides from the benzoylcyclohexanedione group for use in rice crops AVENTIS CROPSCIENCE GBMH (DE) 2003-06-05 US claimed
WO-2002089582-A1 SYNERGISTIC HERBICIDE COMPRISING BENZOYLCYCLOHEXANEDIONES FOR APPLICATION IN RICE CULTIVATION BAYER CROPSCIENCE GMBH (DE) 2002-11-14 WO claimed
WO-2002085118-A2 SYNERGISTIC HERBICIDAL AGENT COMPRISING BENZOYLCYCLOHEXANEDIONES FOR APPLICATION IN RICE CULTIVATION BAYER CROPSCIENCE GMBH (DE) 2002-10-31 WO claimed
US-6376429-B1 CONTROLLING WEEDS HOECHST SCHERING AGREVO GMBH (DE) 2002-04-23 US claimed
EP-1117639-A1 BENZOYLCYCLOHEXANDIONES, METHOD FOR THE PRODUCTION AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS Aventis CropScience GmbH (DE) 2001-07-25 EP claimed
WO-2000021924-A1 BENZOYLCYCLOHEXANDIONES, METHOD FOR THE PRODUCTION AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS AVENTIS CROPSCIENCE GMBH (DE) 2000-04-20 WO claimed
US-20240327702-A1 CURABLE COMPOSITION, CURED LAYER USING THE COMPOSITION AND DISPLAY DEVICE INCLUDING THE CURED LAYER SAMSUNG SDI CO., LTD. (KR) 2024-10-03 US disclosed
US-20220348590-A1 CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF THE BOARD INSTITUTE, INC. (US) 2022-11-03 US disclosed
EP-4027993-A1 CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF The Broad Institute Inc. (US) 2022-07-20 EP disclosed
WO-1996011200-A1 PURINE AND GUANINE COMPOUNDS AS INHIBITORS OF PNP CHIROSCIENCE LIMITED (GB) 1996-04-18 WO disclosed
EP-0302599-A2 Bicyclo-octane and bicyclo-nonane derivatives, processes for their preparation and their use as herbicides HER MAJESTY THE QUEEN IN RIGHT OF NEW ZEALAND, DEPARTMENT OF SCIENTIFIC AND INDUSTRIAL RESEARCH, CHEMISTRY DIVISON (NZ) 1989-02-08 EP disclosed
US-3996373-A 2,3-Dihydro-1H-dibenz[e,g]isoindole compounds CIBA-GEIGY CORPORATION (US) 1976-12-07 US disclosed