SCHEMBL641736

SCHEMBL641736

CC(C)OCCC#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
SCHEMBL12629896 0.86
SCHEMBL19764838 0.84 TSHR (0.42)
SCHEMBL29187298 0.83 TSHR (0.40)
SCHEMBL9153485 0.83 TSHR (0.40)
SCHEMBL18074929 0.79 TSHR (0.37)
SCHEMBL12703256 0.79 TSHR (0.37)
SCHEMBL20369085 0.79 TSHR (0.42)
SCHEMBL20364824 0.79 TSHR (0.37)
SCHEMBL7014958 0.79
SCHEMBL16768602 0.79 TSHR (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117209442-A Synthesis method of beta-aminonitrile compound 四川师范大学 2023-12-12 CN claimed
CN-116053588-A Electrolyte, electrochemical device, and electronic apparatus 东莞新能源科技有限公司 2023-05-02 CN claimed
EP-2943072-B2 METHODS FOR AFFECTING THE FLAVOUR AND AROMA PROFILE OF CONSUMABLES IMPOSSIBLE FOODS INC (US) 2025-04-30 EP disclosed
CN-119874542-A Green synthesis method of alkoxypropylamine 榆林中科洁净能源创新研究院 2025-04-25 CN disclosed
CN-117209442-A Synthesis method of beta-aminonitrile compound 四川师范大学 2023-12-12 CN disclosed
US-11691990-B2 Salts of compounds and crystals thereof EISAI R&D MANAGEMENT CO., LTD (JP) 2023-07-04 US disclosed
WO-2023097308-A1 SYNTHESIS OF 2' ACETYL-ESTER PROTECTED NUCLEOSIDES HONGENE BIOTECH CORPORATION (US) 2023-06-01 WO disclosed
US-11661410-B2 Tricyclic compounds as histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-05-30 US disclosed
US-11661410-B2 Tricyclic compounds as histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-05-30 US disclosed
CN-116053588-A Electrolyte, electrochemical device, and electronic apparatus 东莞新能源科技有限公司 2023-05-02 CN disclosed
US-20230002351-A1 TRICYCLIC COMPOUNDS AS HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2023-01-05 US disclosed
EP-1221437-A1 Process for the preparation of primary and secondary amines from nitriles BASF AKTIENGESELLSCHAFT (DE) 2002-07-10 EP disclosed
EP-1221436-A2 Process for the preparation of secondary amines from nitriles BASF AKTIENGESELLSCHAFT (DE) 2002-07-10 EP disclosed
EP-0673918-B1 Process for the preparation of peralkylated amines BASF AG (DE) 1999-06-02 EP disclosed
US-5894074-A Preparation of tertiary amines from nitriles and secondary amines BASF AKTIENGESELLSCHAFT (DE) 1999-04-13 US disclosed
EP-0869113-A2 Process for the preparation of tertiary amines fromnitriles and secondary amines BASF AKTIENGESELLSCHAFT (DE) 1998-10-07 EP disclosed
US-5463130-A Preparation of peralkylated amines BASF AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
EP-0673918-A1 Process for the preparation of peralkylated amines BASF AKTIENGESELLSCHAFT (DE) 1995-09-27 EP disclosed
US-4148802-A Method of preparing alpha-vinyloxazolines TEXACO DEVELOPMENT CORP. (US) 1979-04-10 US disclosed
US-4007226-A TO FORM AMINES, COBALT OXIDE-SODIUM SILICATE CATALYST EASTMAN KODAK COMPANY (US) 1977-02-08 US disclosed