SCHEMBL442012

SCHEMBL442012

CCOC(C#N)OCC

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
SCHEMBL18114026 0.84
SCHEMBL15134536 0.77 TSHR (0.33)
SCHEMBL28759412 0.75
SCHEMBL11191983 0.73
SCHEMBL319872 0.73
SCHEMBL29282672 0.73 TSHR (0.42)
SCHEMBL10842842 0.71
SCHEMBL1446771 0.71
SCHEMBL30880451 0.71
SCHEMBL555929 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230025327-A1 CONJUGATES OF TUBULYSIN DERIVATIVES AND CELL BINDING MOLECULES AND METHODS OF MAKING HANGZHOU DAC BIOTECH CO., LTD. (CN) 2023-01-26 US claimed
EP-3991752-A1 CELL-BINDING MOLECULE-TUBULYSIN DERIVATIVE CONJUGATE AND PREPARATION METHOD THEREFOR Hangzhou Dac Biotech Co., Ltd (CN) 2022-05-04 EP claimed
CN-114040778-A Cell binding molecule-Tubulysin derivative conjugate and preparation method thereof 杭州多禧生物科技有限公司 2022-02-11 CN claimed
WO-2021000067-A1 CELL-BINDING MOLECULE-TUBULYSIN DERIVATIVE CONJUGATE AND PREPARATION METHOD THEREFOR 杭州多禧生物科技有限公司 2021-01-07 WO claimed
CN-117024411-B Isoquinoline as HPK1 inhibitor 豪夫迈·罗氏有限公司 2026-05-19 CN disclosed
EP-4211119-B1 2-AMINOQUINAZOLINES AS LRRK2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME LLC (US) 2026-05-13 EP disclosed
US-20260108619-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LINKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2026-04-23 US disclosed
CN-121850950-A Preparation method of 2-cyano pyrimidine and 2-methylaminopyrimidine hydrochloride 南京艾德凯腾生物医药有限责任公司 2026-04-14 CN disclosed
US-20260091081-A1 A FORMULATION OF A CONJUGATE OF A TUBULYSIN ANALOG TO A CELL-BINDING MOLECULE HANGZHOU DAC BIOTECH CO., LTD (CN) 2026-04-02 US disclosed
US-12576124-B2 Formulation of a conjugate of a tubulysin analog to a cell-binding molecule HANGZHOU DAC BIOTECH CO., LTD (CN) 2026-03-17 US disclosed
US-12570640-B2 2-aminoquinazolines as LRRK2 inhibitors, pharmaceutical compositions, and uses thereof MERCK SHARP & DOHME LLC (US) 2026-03-10 US disclosed
EP-3826722-B1 ISOQUINOLINE COMPOUNDS AND USES THEREOF HOFFMANN LA ROCHE (CH) 2026-02-18 EP disclosed
US-4496388-A FUNGICIDES; PLANT GROWTH REGULATORS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-01-29 US disclosed
EP-0078594-A1 Triazole derivatives, processes for preparing them, compositions containing them and processes for combating fungi and regulating plant growth IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-05-11 EP disclosed
US-4107217-A INTERMEDIATED 3-ALKENALS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-08-15 US disclosed
US-4088696-A MULTISTAGE FROM AN ACETYLENIC KETONE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-05-09 US disclosed
US-4045497-A Processes for producing alkenals and intermediates therefor INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-08-30 US disclosed
US-4024190-A ORGANO-LEPTIC INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1977-05-17 US disclosed
US-3988487-A Foodstuff flavoring compositions comprising alkylidene alkenals and processes for preparing same as well as flavoring compositions for use in such foodstuff INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-10-26 US disclosed
US-3970701-A 2-ETHYLIDENE-3-HEXENAL, ORGANOLEPTIC INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1976-07-20 US disclosed