SCHEMBL2185685

SCHEMBL2185685

CC1(C)CS[CH]SC1

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
SCHEMBL10869507 0.67
SCHEMBL13864467 0.65 MAPT (0.30)
SCHEMBL6973666 0.59
SCHEMBL1864407 0.59
SCHEMBL347837 0.59
SCHEMBL7930276 0.55
SCHEMBL2755796 0.55
SCHEMBL4639 0.54
SCHEMBL23034919 0.52
SCHEMBL5432 0.51

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2343276-A1 2-Benzoyl-cyclohexan-1,3-diones as herbicides BASF SE (DE) 2011-07-13 EP disclosed
EP-1003730-B1 2-BENZOYL-CYCLOHEXANE-1,3-DIONES BASF AG (DE) 2007-05-30 EP disclosed
EP-0960095-B1 3-AMINOCARBONYL/3-AMINOTHIOCARBONYL-SUBSTITUTED 2-BENZOYL- CYCLOHEXAN-1,3-DIONES WITH HERBICIDAL EFFECT BASF AG (DE) 2003-10-01 EP disclosed
US-6576596-B1 Compatible with crop plants BASF AKTIENGESELLSCHAFT (DE) 2003-06-10 US disclosed
US-6559100-B1 Herbicidal activity of the substituted 2-benzoylcyclohexane-1,3-diones of the formula I was demonstrated by greenhouse experiments BASF AKTIENGESELLSCHAFT (DE) 2003-05-06 US disclosed
EP-0931070-B1 HETAROYL CYCLOHEXANEDIONE DERIVATIVES WITH HERBICIDAL EFFECT BASF AG (DE) 2003-03-19 EP disclosed
EP-0983255-B1 SUBSTITUTED 2-BENZOYL-CYCLOHEXANE-1,3-DIONES BASF AG (DE) 2003-01-29 EP disclosed
US-6479436-B1 SUCH AS 2-(8-BROMOQUINOLIN-5-YL)CARBONYL-1,3-CYCLOHEXANEDIONE BASF AKTIENGESELLSCHAFT (DE) 2002-11-12 US disclosed
US-6432881-B1 APPLYING TO PLANT, SEEDS, ENVIRONMENT; 2-BENZOYLCYCLOHEXANE-1,3-DIONE COMPOUND BASF AKTIENGESELLSCHAFT (DE) 2002-08-13 US disclosed
US-6372693-B1 AGRICULTURAL HERBICIDES FOR CONTROLLING WEEDS BASF AKTIENGESELLSCHAFT (DE) 2002-04-16 US disclosed
EP-0958276-B1 SUBSTITUTED 2-BENZOYL-CYCLOHEXAN-1,3-DIONES WITH HERBICIDAL EFFECT BASF AG (DE) 2002-03-13 EP disclosed
US-6310245-B1 FOR CONTROLLING UNDESIRABLE VEGETATION; CROP PROTECTION BASF AKTIENGESELLSCHAFT (DE) 2001-10-30 US disclosed
US-20010031865-A1 Substituted 3-phenyluracils KLINTZ RALF (DE) 2001-10-18 US disclosed
US-6239074-B1 HERBICIDES, INSECTICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-05-29 US disclosed
US-6165944-A 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2000-12-26 US disclosed
US-6140273-A HERBICIDES; MADE BY REACTING A CYCLOHEXANE-1,3-DIONE WITH AN ACTIVATED BENZOIC ACID OR BENZOIC ACID COMPOUND, TO GIVE AN ACYLATION PRODUCT, AND SUBSEQUENT REARRANGEMENT BASF AKTIENGESELLSCHAFT (DE) 2000-10-31 US disclosed
EP-0984914-A1 SUBSTITUTED 2-(3-ALKENYL-BENZOYL)-CYCLOHEXANE-1,3-DIONES BASF AKTIENGESELLSCHAFT (DE) 2000-03-15 EP disclosed
WO-1998050337-A1 SUBSTITUTED 2-(3-ALKENYL-BENZOYL)-CYCLOHEXANE-1,3-DIONES BASF AKTIENGESELLSCHAFT (DE) 1998-11-12 WO disclosed
EP-0604491-A1 SUBSTITUTED 3-PHENYLURACILS AS HERBICIDES BASF Aktiengesellschaft (DE) 1994-07-06 EP disclosed
WO-1993006090-A1 SUBSTITUTED 3-PHENYLURACILS AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-04-01 WO disclosed