SCHEMBL3360849

SCHEMBL3360849

C=CC(C)CN

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 SCHEMBL22771744 0.97
SCHEMBL17470068 0.77
SCHEMBL13771114 0.75
SCHEMBL24972186 0.75 ALDH1A1 (0.30)
Hydrochloric Acid SCHEMBL29997351 0.73
SCHEMBL5071748 0.72
SCHEMBL3253778 0.72
SCHEMBL21312644 0.72
SCHEMBL22428705 0.72
SCHEMBL466875 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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111548526-B Quaternary ammonium salt type dendritic polythioether modified polymer microsphere 烟台大学 2022-04-26 CN claimed
CN-109659604-B Solid electrolyte composite material and preparation method and application thereof 北京大学深圳研究生院 2020-09-01 CN claimed
CN-111548526-A Quaternary ammonium salt type dendritic polythioether modified polymer microsphere 烟台大学 2020-08-18 CN claimed
CN-109659604-A A kind of solid electrolyte composite material and preparation method and application 北京大学深圳研究生院 2019-04-19 CN claimed
WO-2025067239-A1 KINESIN KIF18A INHIBITOR, AND APPLICATION THEREOF 上海湃隆生物科技有限公司 2025-04-03 WO disclosed
EP-4371979-A1 FORMAMIDE DERIVATIVE AND AGRICULTURAL OR HORTICULTURAL PLANT DISEASE CONTROL AGENT Kumiai Chemical Industry Co., Ltd. (JP) 2024-05-22 EP disclosed
CN-117693500-A Carboxamide derivative and agricultural/horticultural plant disease control agent 组合化学工业株式会社 2024-03-12 CN disclosed
WO-2023286855-A1 FORMAMIDE DERIVATIVE AND AGRICULTURAL OR HORTICULTURAL PLANT DISEASE CONTROL AGENT クミアイ化学工業株式会社 2023-01-19 WO disclosed
CN-111548526-B Quaternary ammonium salt type dendritic polythioether modified polymer microsphere 烟台大学 2022-04-26 CN disclosed
CN-109659604-B Solid electrolyte composite material and preparation method and application thereof 北京大学深圳研究生院 2020-09-01 CN disclosed
CN-111548526-A Quaternary ammonium salt type dendritic polythioether modified polymer microsphere 烟台大学 2020-08-18 CN disclosed
CN-109659604-A A kind of solid electrolyte composite material and preparation method and application 北京大学深圳研究生院 2019-04-19 CN disclosed
WO-2005064008-A9 METHOD AND COMPOSITIONS FOR IDENTIFYING ANTI-HIV THERAPEUTIC COMPOUNDS GILEAD SCIENCES INC (US) 2006-09-28 WO disclosed
US-20050239054-A1 Method and compositions for identifying anti-HIV therapeutic compounds GILEAD SCIENCES. INC. 2005-10-27 US disclosed
US-20050209197-A1 Cellular accumulation of phosphonate analogs of HIV protease inhibitor compounds GILEAD SCIENCES, INC. 2005-09-22 US disclosed
WO-2005064008-A1 METHOD AND COMPOSITIONS FOR IDENTIFYING ANTI-HIV THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 2005-07-14 WO disclosed
EP-1509537-A2 CELLULAR ACCUMULATION OF PHOSPHONATE ANALOGS OF HIV PROTEASE INHIBITOR COMPOUNDS AND THE COMPOUNDS AS SUCH GILEAD SCIENCES, INC. (US) 2005-03-02 EP disclosed
WO-2003090690-A2 CELLULAR ACCUMULATION OF PHOSPHONATE ANALOGS OF HIV PROTEASE INHIBITOR COMPOUNDS AND THE COMPOUNDS AS SUCH GILEAD SCIENCES, INC. (US) 2003-11-06 WO disclosed
WO-1994022897-A1 17β-SUBSTITUTED ANDROSTA-3,5-DIENE DERIVATIVES CIBA-GEIGY AG (CH) 1994-10-13 WO disclosed
US-4622368-A Plasticized polyetherimide blends GENERAL ELECTRIC COMPANY (US) 1986-11-11 US disclosed