SCHEMBL3203754

SCHEMBL3203754

C#CCOC(=O)C#C

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
SCHEMBL2828911 0.83 NPC1 (0.45)
SCHEMBL16875652 0.79
SCHEMBL24347877 0.77 THRA (0.32)
SCHEMBL291486 0.77 NPC1 (0.48)
SCHEMBL14922481 0.77
SCHEMBL1401583 0.77 NPC1 (0.48)
SCHEMBL26871474 0.75 SLC1A3 (0.39)
SCHEMBL10010445 0.75
SCHEMBL2241578 0.74
SCHEMBL291487 0.74

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240014444-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM BATTERY ZHANGJIAGANG GUOTAI-HUARONG NEW CHEMICAL MATERIALS CO., LTD (CN) 2024-01-11 US claimed
EP-4199168-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM BATTERY Zhangjiagang Guotai-Huarong New Chemical Materials Co., Ltd (CN) 2023-06-21 EP claimed
WO-2022111293-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM BATTERY 张家港市国泰华荣化工新材料有限公司 2022-06-02 WO claimed
CN-112510259-B Non-aqueous electrolyte and lithium battery 张家港市国泰华荣化工新材料有限公司 2022-04-22 CN claimed
CN-112510259-A Non-aqueous electrolyte and lithium battery 张家港市国泰华荣化工新材料有限公司 2021-03-16 CN claimed
US-20240014444-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM BATTERY ZHANGJIAGANG GUOTAI-HUARONG NEW CHEMICAL MATERIALS CO., LTD (CN) 2024-01-11 US disclosed
EP-4199168-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM BATTERY Zhangjiagang Guotai-Huarong New Chemical Materials Co., Ltd (CN) 2023-06-21 EP disclosed
US-20100029888-A1 Click-Reaction Crosslinkable Multicomponent Silicone Compositions WACKER CHEMIE AG (DE) 2010-02-04 US disclosed
US-7173149-B2 Process for preparing alkynecarboxylic acids by oxidation of alkyne alcohols Consortium für elektrochemische Industrie GmbH (DE) 2007-02-06 US disclosed
US-20040059154-A1 Process for preparing alkynecarboxylic acids by oxidation of alkyne alcohols CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH 2004-03-25 US disclosed
US-20030158439-A1 Preparation of alkynecarboxylic acids and alkyne alcohol esters of alkynecarboxylic acids by oxidation of alkyne alcohols CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH 2003-08-21 US disclosed
EP-0138523-B1 PENICILLIN DERIVATIVES AND PROCESS FOR PREPARING THE SAME (11111) TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1987-08-19 EP disclosed
US-4668514-A Penicillin derivatives TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1987-05-26 US disclosed
EP-0138523-A1 Penicillin derivatives and process for preparing the same (11111) TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1985-04-24 EP disclosed