SCHEMBL441930

SCHEMBL441930

C[C](C)OC(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
SCHEMBL4443775 0.75 TSHR (0.53)
SCHEMBL854258 0.72
SCHEMBL21247 0.70 TSHR (0.47)
SCHEMBL8545100 0.69
SCHEMBL10196614 0.69
SCHEMBL891293 0.69
SCHEMBL19193 0.69
SCHEMBL21064874 0.69 TSHR (1.00)
SCHEMBL3483417 0.68 TSHR (0.52)
Methyl Alcohol SCHEMBL584909 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180020662-A1 Substituted 1-cycloalkyl-2-oxotetrahydroquinolin-6-ylsulfonamides or salts thereof and use thereof to increase stress tolerance in plants BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-01-25 US claimed
CN-107531635-A Substituted 1-cycloalkyl-2-oxotetrahydroquinolin-6-yl sulfonamides or salts thereof and their use for enhancing stress tolerance in plants 拜耳作物科学股份公司 2018-01-02 CN claimed
EP-3256448-A1 SUBSTITUTED 1-CYCLOALKYL-2-OXOTETRAHYDROQUINOLIN-6-YL-SULFONAMIDES OR SALTS THEREOF AND USE THEREOF TO INCREASE STRESS TOLERANCE IN PLANTS Bayer CropScience Aktiengesellschaft (DE) 2017-12-20 EP claimed
WO-2016128365-A1 SUBSTITUTED 1-CYCLOALKYL-2-OXOTETRAHYDROQUINOLIN-6-YL-SULFONAMIDES OR SALTS THEREOF AND USE THEREOF TO INCREASE STRESS TOLERANCE IN PLANTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-08-18 WO claimed
CN-1513174-A Optical data carrier containing axially substituted co-phthalocynine in the information layer that can be written with light 2004-07-14 CN claimed
US-5387607-A Fungicides BASF AKTIENGESELLSCHAFT (DE) 1995-02-07 US claimed
EP-0408227-A1 Photohardenable or photosoftenable compositions THE MEAD CORPORATION (US) 1991-01-16 EP claimed
US-4567283-A EPOXYCYCLOHEXANOLS SHELL OIL COMPANY (US) 1986-01-28 US claimed
WO-2024104425-A1 KRAS INHIBITOR COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF 广东东阳光药业股份有限公司 2024-05-23 WO disclosed
US-11976057-B2 MrgX2 antagonists GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2024-05-07 US disclosed
WO-2024078555-A1 PYRIMIDOPYRIDINE COMPOUND, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 广东东阳光药业股份有限公司 2024-04-18 WO disclosed
WO-2024073576-A1 4-((2-(3,5-DICHLOROPHENYL)-6-((PYRIMIDIN-5-YL)OXY)PYRIDIN-4-YL)METHYL)PIPERAZINE DERIVATIVES AS FURIN INHIBITORS AND USES THEREOF BP ASSET V, INC. (US) 2024-04-04 WO disclosed
EP-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 EP disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
EP-0173857-A1 Fungicidal agent based on phosphoryloximinoacetamide BAYER AG (DE) 1986-03-12 EP disclosed
EP-0146105-A2 Iminomethyl-azolyl derivatives BAYER AG (DE) 1985-06-26 EP disclosed
EP-0132676-A2 Phosphoric or phosphonic acid esters BAYER AG (DE) 1985-02-13 EP disclosed
EP-0054946-B1 BASIC SUBSTITUTED PYRIDAZINES, THEIR PREPARATION AND THEIR USE CASSELLA Aktiengesellschaft (DE) 1984-08-15 EP disclosed
EP-0100476-A2 Phosphoric-acid esters, process for their preparation and their use as pesticides BAYER AG (DE) 1984-02-15 EP disclosed
US-4044130-A ANIMAL FEED, 4-AMINO-3-5-NITRO-2-FURYL-1H-PYRAZOLO-3,4-D PYRIMIDINE N CIBA-GEIGY CORPORATION (US) 1977-08-23 US disclosed