SCHEMBL8061997

SCHEMBL8061997

C#CC(C)(N)CC

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
Hydrochloric Acid SCHEMBL7026896 0.97
SCHEMBL12826504 0.77
Hydrochloric Acid SCHEMBL15638480 0.75
SCHEMBL31423335 0.73
SCHEMBL20442255 0.73
SCHEMBL155400 0.71
SCHEMBL479178 0.71
SCHEMBL5964038 0.71 FDPS (0.39)
Hydrochloric Acid SCHEMBL6670511 0.71
SCHEMBL5956539 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114262271-B Preparation method and application of 3-methyl-3-amino-1-pentyne 浙江宇龙药业有限公司 2025-06-24 CN claimed
CN-114262271-A Preparation method and application of 3-methyl-3-amino-1-pentyne 杭州宇龙化工有限公司 2022-04-01 CN claimed
CN-101613287-B Method for synthesizing 3-methyl-3-amidogen-1-pentyne DALIAN CHEMPHY CHEMICAL CO LTD 2012-10-10 CN claimed
CN-101613287-A The method of a kind of synthetic 3-methyl-3-amido-1-pentyne DALIAN CHEMPHY CHEMICAL CO LTD 2009-12-30 CN claimed
JP-10114727-A None JP disclosed
JP-6192196-A None JP disclosed
CN-114262271-B Preparation method and application of 3-methyl-3-amino-1-pentyne 浙江宇龙药业有限公司 2025-06-24 CN disclosed
CN-114262271-B Preparation method and application of 3-methyl-3-amino-1-pentyne 浙江宇龙药业有限公司 2025-06-24 CN disclosed
CN-114262271-B Preparation method and application of 3-methyl-3-amino-1-pentyne 浙江宇龙药业有限公司 2025-06-24 CN disclosed
CN-114262271-A Preparation method and application of 3-methyl-3-amino-1-pentyne 杭州宇龙化工有限公司 2022-04-01 CN disclosed
CN-114262271-A Preparation method and application of 3-methyl-3-amino-1-pentyne 杭州宇龙化工有限公司 2022-04-01 CN disclosed
CN-114262271-A Preparation method and application of 3-methyl-3-amino-1-pentyne 杭州宇龙化工有限公司 2022-04-01 CN disclosed
JP-H06192196-A N-ACETONYLBENZAMIDE AND FUNGICIDAL COMPOSITION CONTAINING THE SAME ROHM & HAAS CO 1994-07-12 JP disclosed
EP-0604019-A1 N-Acetonylbenzamides and their use as fungicides ROHM AND HAAS COMPANY (US) 1994-06-29 EP disclosed
EP-0600629-A1 N-acetonylbenzamides and their use as fungicides ROHM AND HAAS COMPANY (US) 1994-06-08 EP disclosed
US-5304572-A N-acetonylbenzamides and their use as fungicides ROHM AND HAAS COMPANY (US) 1994-04-19 US disclosed
US-5254584-A Controlling phytopathogens ROHM AND HAAS COMPANY (US) 1993-10-19 US disclosed
US-3956494-A ANTISECRETORY AGENTS, HETEROCYCLIC THIOPROPIONAMIDES SMITHKLINE CORPORATION (US) 1976-05-11 US disclosed
US-3950522-A N-ALKENYL OR N-ALKYNYL THIOAMIDES SMITHKLINE CORPORATION (US) 1976-04-13 US disclosed
US-3948892-A 2-Alkoxy(and 2-amino)-3-amino-2-heterocyclic-thiopropanamides SMITHKLINE CORPORATION (US) 1976-04-06 US disclosed