SCHEMBL104113

SCHEMBL104113

CCC(C)(C)CO[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
SCHEMBL7631314 0.77
SCHEMBL3044994 0.77
SCHEMBL6141334 0.77
SCHEMBL27708462 0.77
SCHEMBL10529460 0.77
SCHEMBL3037987 0.75 CES2 (0.34)
SCHEMBL28202 0.75
SCHEMBL3744477 0.74
SCHEMBL3045134 0.73
SCHEMBL11503738 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12029217-B2 Safened compositions comprising pyridine carboxylate herbicides and isoxadifen CORTEVA AGRISCIENCE LLC (US) 2024-07-09 US disclosed
US-20240174601-A1 COMPOSITION COMPRISING HETEROCYCLIC COMPOUND AND 4,4'-METHYLENE DIPHENYL DIISOCYANATE BASF SE (DE) 2024-05-30 US disclosed
EP-4308542-A1 COMPOSITION COMPRISING HETEROCYCLIC COMPOUND AND 4,4'-METHYLENE DIPHENYL DIISOCYANATE BASF SE (DE) 2024-01-24 EP disclosed
EP-3559007-B1 SULFONAMIDE COMPOUNDS HAVING TNAP INHIBITORY ACTIVITY DAIICHI SANKYO CO LTD (JP) 2023-08-16 EP disclosed
US-20230094952-A1 Method for Culturing Hematopoietic Stem Cells Sumitomo Pharma Co., Ltd. (JP) 2023-03-30 US disclosed
US-20230022569-A1 COMPOSITIONS COMPRISING PYRIDINE CARBOXYLATE HERBICIDES WITH ACETOLACTATE SYNTHASE (ALS) INHIBITOR HERBICIDES CORTEVA AGRISCIENCE LLC (US) 2023-01-26 US disclosed
US-20230009120-A1 COMPOSITIONS COMPRISING PYRIDINE CARBOXYLATE HERBICIDES WITH SYNTHETIC AUXIN HERBICIDES OR AUXIN TRANSPORT INHIBITORS CORTEVA AGRISCIENCE LLC (US) 2023-01-12 US disclosed
EP-4071239-A1 METHOD FOR CULTURING HEMATOPOIETIC STEM CELLS Sumitomo Pharma Co., Ltd. (JP) 2022-10-12 EP disclosed
US-20220007644-A1 COMPOSITIONS COMPRISING PYRIDINE CARBOXYLATE HERBICIDES WITH PHOTOSYSTEM II AND OPTIONAL HPPD INHIBITOR HERBICIDES CORTEVA AGRISCIENCE LLC (US) 2022-01-13 US disclosed
US-20220000110-A1 COMPOSITIONS COMPRISING PYRIDINE CARBOXYLATE HERBICIDES AND CELLULOSE BIOSYNTHESIS INHIBITOR HERBICIDES CORTEVA AGRISCIENCE LLC (US) 2022-01-06 US disclosed
EP-0475158-A2 Use of alpha aryl acrylic acid derivatives for pest control BASF Aktiengesellschaft (DE) 1992-03-18 EP disclosed
US-5068340-A Antagonist of platelet activating factor for treatment of asthma, inflammation or shock SANKYO COMPANY, LIMITED (JP) 1991-11-26 US disclosed
US-5057143-A Herbicides, plant growth regulators BASF AKTIENGESELLSCHAFT (DE) 1991-10-15 US disclosed
EP-0437016-A2 Lipid A analogues having immunoactivating and anti-tumour activity Sankyo Company Limited (JP) 1991-07-17 EP disclosed
EP-0435104-A2 Salicylic acid derivatives, process for their preparation and their use as herbicide and bioregulators BASF Aktiengesellschaft (DE) 1991-07-03 EP disclosed
EP-0414112-A2 Herbicides thiadiazabicyclononan derivatives BASF Aktiengesellschaft (DE) 1991-02-27 EP disclosed
EP-0402751-A1 Derivatives of salicylic aldehyde and salicylic acid and sulphur analoges thereof, methodes for preparing them and their use as herbicides and bioregulators BASF Aktiengesellschaft (DE) 1990-12-19 EP disclosed
EP-0398115-A1 Herbicidal n-phenyltetrahydrophthalimides, preparation and compositions BASF Aktiengesellschaft (DE) 1990-11-22 EP disclosed
EP-0346789-A2 Salicylic-acid derivatives and their sulfur analogues BASF Aktiengesellschaft (DE) 1989-12-20 EP disclosed
EP-0238202-A2 Glycerol derivatives, their preparation and their therapeutic use Sankyo Company Limited (JP) 1987-09-23 EP disclosed