SCHEMBL839656

SCHEMBL839656

CCC(C)CC(=O)Cl

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
SCHEMBL9724921 1.00
SCHEMBL9868411 0.85 ALDH1A1 (0.38)
SCHEMBL1410639 0.79
SCHEMBL10608159 0.79
SCHEMBL20232410 0.78
SCHEMBL1882238 0.78
SCHEMBL3381726 0.78
SCHEMBL1509686 0.77 TDP1 (0.37)
SCHEMBL9652062 0.76 ALDH1A1 (0.50)
SCHEMBL666348 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106795174-B Antiviral active diazacyclospirodiketopiperazine alkaloid derivative and preparation method thereof 扬州蓝色生物医药科技有限公司 2020-04-28 CN claimed
US-20250243161-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS SENSORIUM THERAPEUTICS, INC. 2025-07-31 US disclosed
US-12269800-B2 Delivery of therapeutic alkaloid compounds SENSORIUM THERAPEUTICS, INC. (US) 2025-04-08 US disclosed
US-20250051277-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS SENSORIUM THERAPEUTICS, INC. 2025-02-13 US disclosed
US-20240246910-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS SENSORIUM THERAPEUTICS, INC. 2024-07-25 US disclosed
US-11999694-B2 Delivery of therapeutic alkaloid compounds SENSORIUM THERAPEUTICS, INC. (US) 2024-06-04 US disclosed
CN-114369063-B Pyrazolyl acrylonitrile compound and preparation method and application thereof 沈阳农业大学 2023-09-26 CN disclosed
US-20230159455-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS SENSORIUM THERAPEUTICS, INC. 2023-05-25 US disclosed
US-20230159455-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS SENSORIUM THERAPEUTICS, INC. 2023-05-25 US disclosed
US-20230159455-A1 DELIVERY OF THERAPEUTIC ALKALOID COMPOUNDS SENSORIUM THERAPEUTICS, INC. 2023-05-25 US disclosed
EP-0143601-A2 Method for producing 1-iodoalkyl acylates Takeda Chemical Industries, Ltd. (JP) 1985-06-05 EP disclosed
US-4394070-A Helichromic compounds and displays MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1983-07-19 US disclosed
US-4336400-A BRONCHODILATOR AGENTS, CARDIOVASCULAR STIMULANTS STERLING DRUG INC. (US) 1982-06-22 US disclosed
US-4257911-A P-ALKYLOXYPHENYL ESTERS OF 4-BRANCHING ALKYL BIPHENYL-4'-CARBOXYLIC ACID; EUTECTIC MIXTURES HAVING CHOLESTIC PHASES AT LOWER TEMPERATURES THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1981-03-24 US disclosed
US-RE30241-E BRONCHODILATION, ADRENERGIC STIMULANTS STERLING DRUG INC. (US) 1980-03-25 US disclosed
US-4149413-A THERMOCHROMIC THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHER IRELAND (GB) 1979-04-17 US disclosed
US-4138581-A BRONCHODILATOR AGENTS, ADRENERGIC STIMULANTS STERLING DRUGS INC. (US) 1979-02-06 US disclosed
US-4091823-A ORGANOLEPTIC PROPERTIES LIGGETT GROUP INC. (US) 1978-05-30 US disclosed
US-4053698-A ACYLATION OF PYRAZOFURIN ELI LILLY AND COMPANY (US) 1977-10-11 US disclosed
US-3960836-A Acylated derivatives of pyrazofurin and process for their preparation ELI LILLY AND COMPANY (US) 1976-06-01 US disclosed