SCHEMBL555910

SCHEMBL555910

CCCC(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
SCHEMBL28662298 0.88 TSHR (0.40)
SCHEMBL22444505 0.86 OPRM1 (0.41)
SCHEMBL22444561 0.84 OPRM1 (0.39)
SCHEMBL22444547 0.84 OPRM1 (0.39)
SCHEMBL22444434 0.84 OPRM1 (0.39)
SCHEMBL28429177 0.83
SCHEMBL7321254 0.81
SCHEMBL6046409 0.79
SCHEMBL28439339 0.79 TSHR (0.37)
SCHEMBL555929 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111326792-B Electrolyte and battery 宁德时代新能源科技股份有限公司 2021-02-23 CN claimed
CN-111326791-B Electrolyte and battery 宁德时代新能源科技股份有限公司 2021-01-15 CN claimed
CN-111326792-A Electrolyte and battery 宁德时代新能源科技股份有限公司 2020-06-23 CN claimed
CN-111326791-A Electrolyte and battery 宁德时代新能源科技股份有限公司 2020-06-23 CN claimed
US-8980481-B2 Non-aqueous electrolyte solution for lithium secondary battery and lithium secondary battery including the same LG CHEM, LTD. (KR) 2015-03-17 US claimed
EP-2424029-B1 NON-AQUEOUS ELECTROLYTE FOR RECHARGEABLE LITHIUM BATTERIES AND A RECHARGEABLE LITHIUM BATTERY COMPRISING THE SAME LG CHEMICAL LTD (KR) 2013-06-05 EP claimed
EP-2424029-A2 NON-AQUEOUS ELECTROLYTE FOR RECHARGEABLE LITHIUM BATTERIES AND A RECHARGEABLE LITHIUM BATTERY COMPRISING THE SAME LG Chem, Ltd. (KR) 2012-02-29 EP claimed
US-20120034533-A1 NON-AQUEOUS ELECTROLYTE SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY INCLUDING THE SAME LG CHEM, LTD. (KR) 2012-02-09 US claimed
CN-113574041-A Method for producing bisphenol and method for producing polycarbonate resin 三菱化学株式会社 2021-10-29 CN disclosed
CN-111326792-B Electrolyte and battery 宁德时代新能源科技股份有限公司 2021-02-23 CN disclosed
CN-111326791-B Electrolyte and battery 宁德时代新能源科技股份有限公司 2021-01-15 CN disclosed
WO-2020189201-A1 METHOD FOR PRODUCING BISPHENOL AND METHOD FOR PRODUCING POLYCARBONATE RESIN 三菱ケミカル株式会社 2020-09-24 WO disclosed
CN-111326791-A Electrolyte and battery 宁德时代新能源科技股份有限公司 2020-06-23 CN disclosed
CN-111326792-A Electrolyte and battery 宁德时代新能源科技股份有限公司 2020-06-23 CN disclosed
US-20120034533-A1 NON-AQUEOUS ELECTROLYTE SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY INCLUDING THE SAME LG CHEM, LTD. (KR) 2012-02-09 US disclosed
US-5466821-A Triazole ring containing fungicides, intermediates ZENECA LIMITED (GB) 1995-11-14 US disclosed
US-5395942-A Fungicides for plants ZENECA LIMITED (GB) 1995-03-07 US disclosed
US-5204363-A Plant fungicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-04-20 US disclosed
US-5004494-A Fungicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-02 US disclosed
EP-0061835-A1 Triazole compounds, a process for preparing them, their use as plant fungicides and fungicidal compositions containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-10-06 EP disclosed