SCHEMBL15634

SCHEMBL15634

CC(C)CC(O)C#N

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
SCHEMBL3466585 1.00
SCHEMBL3467019 1.00
SCHEMBL6011795 0.78
SCHEMBL10950891 0.76
SCHEMBL10794964 0.75 TSHR (0.35)
SCHEMBL24710491 0.72 CTSL (0.31)
SCHEMBL10946888 0.72 TSHR (0.42)
SCHEMBL7752949 0.71
SCHEMBL487461 0.71
Acetonitrile SCHEMBL11376983 0.71 TSHR (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119472164-A Chiral photopolymer composition, holographic grating and holographic device 杭州光粒科技有限公司 2025-02-18 CN disclosed
CN-119192025-A Industrial preparation method and application of alpha-hydroxynitrile 哈尔滨理工大学 2024-12-27 CN disclosed
CN-115838543-B Photopolymer composition and grating containing organosilicon film forming agent 杭州光粒科技有限公司 2024-06-07 CN disclosed
CN-117631447-A Photopolymer with strong adhesive force and grating 奥提赞光晶(上海)显示技术有限公司 2024-03-01 CN disclosed
CN-115595001-B Photosensitive polymer composition, preparation method thereof and holographic diffraction grating element 杭州光粒科技有限公司 2024-01-09 CN disclosed
US-11708348-B2 Protease inhibitors for treatment of coronavirus infections THE SCRIPPS RESEARCH INSTITUTE (US) 2023-07-25 US disclosed
CN-113527143-B Writing monomer, preparation method thereof, photopolymer composition and grating thereof 杭州光粒科技有限公司 2023-06-20 CN disclosed
CN-112764159-B Optical waveguide element, method of manufacturing the same, and holographic optical waveguide display device 杭州光粒科技有限公司 2023-06-16 CN disclosed
US-20230146407-A1 CURABLE COMPOSITION, CURED PRODUCT, AND METHODS THEREOF KANEKA AMERICAS HOLDING, INC. 2023-05-11 US disclosed
CN-115838543-A Photopolymer composition containing organic silicon film forming agent and grating 杭州光粒科技有限公司 2023-03-24 CN disclosed
EP-2205602-A1 IMIDAZOÝL,2- ¨QUINOXALINES AND DERIVATIVES THEREOF FOR TREATING CANCERS Université de Montpellier I (FR) 2010-07-14 EP disclosed
WO-2010070593-A2 MALONATE ESTERS PFIZER IRELAND PHARMACEUTICALS (IE) 2010-06-24 WO disclosed
WO-2009043934-A1 IMIDAZO[L,2-α]QUINOXALINES AND DERIVATIVES THEREOF FOR TREATING CANCERS UNIVERSITE DE MONTPELLIER I (FR) 2009-04-09 WO disclosed
EP-0271868-B1 Process for preparing optically active cyano compound KANEGAFUCHI CHEMICAL IND (JP) 1993-12-15 EP disclosed
US-5077427-A PREPARATION OF ALPHA-FORMYLAMINO NITRILES BASF AKTIENGESELLSCHAFT (DE) 1991-12-31 US disclosed
US-5003083-A Aldehyde Cyanation in presence of a Titanate KANEGAFUCHI CHEMICAL INDUSTRY, CO., LTD. (JP) 1991-03-26 US disclosed
EP-0271868-A2 Process for preparing optically active cyano compound Kanegafuchi Chemical Industry Co., Ltd. (JP) 1988-06-22 EP disclosed
US-4526798-A Mixtures of one or more C4 -C10 -n-alkanoic acids with the ethyl ester of 2-hydroxy-4-methyl pentanoic acid INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-07-02 US disclosed
US-4511562-A (Thio)(dithio-phosphates(phosphonates), processes for their preparation, and their use in pest-combating agents BAYER AKTIENGESELLSCHAFT (DE) 1985-04-16 US disclosed
US-4499114-A UPGRADING ORGANOLEPTIC PROPERTIES TO SIMULATE RIPENESS; BEVERAGES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-02-12 US disclosed