SCHEMBL96833

SCHEMBL96833

C/C=C/CC[O]

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
SCHEMBL4004245 1.00
SCHEMBL96834 1.00
SCHEMBL7289512 0.94 PPARG (0.31)
SCHEMBL7289510 0.94 PPARG (0.31)
SCHEMBL7463356 0.82
SCHEMBL7463358 0.82
SCHEMBL15400347 0.80
SCHEMBL98124 0.80
SCHEMBL98123 0.80
SCHEMBL1141690 0.78

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 1210 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115710515-A Liquid crystal composition, display panel and electronic device TCL华星光电技术有限公司 2023-02-24 CN claimed
EP-1638962-A2 SUBSTITUTED OXYARENES UND DEREN VERWENDUNG ZUR BEKÄMPFUNG VON SCHÄDLINGEN Bayer CropScience AG (DE) 2006-03-29 EP claimed
WO-2004099197-A2 SUBSTITUTED OXYARENES, AND USE THEREOF FOR CONTROLLING PESTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-11-18 WO claimed
CN-114008045-B Agricultural and horticultural agent containing novel imidazopyridine-2-carboxamide derivative as active ingredient 阿格罗-金正株式会社 2024-07-16 CN disclosed
CN-118317956-A Bis (hetero) aryl thioether oxadiazines as fungicidal compounds 拜耳公司 2024-07-09 CN disclosed
CN-118099523-A Electrolyte additive, nonaqueous electrolyte, lithium ion battery, battery module, battery pack and electricity utilization device 上海如鲲新材料股份有限公司 2024-05-28 CN 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-113913193-B Liquid crystal compound having negative dielectric anisotropy, liquid crystal composition, and liquid crystal display device 烟台显华科技集团股份有限公司 2024-05-17 CN disclosed
US-20240148699-A1 OXAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2024-05-09 US disclosed
CN-117976981-A Nonaqueous electrolyte and lithium ion battery 上海如鲲新材料股份有限公司 2024-05-03 CN disclosed
CN-112789551-B Liquid crystal light modulation element 捷恩智株式会社 2024-04-30 CN disclosed
US-4629581-A Cyclohexanecarbonitriles HOFFMANN-LA ROCHE INC. (US) 1986-12-16 US disclosed
EP-0203798-A2 Nitrogen-containing heterocyclic compounds, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-12-03 EP disclosed
US-4616008-A LIPID-SOLUBLE CEPHALOSPORINS AND CYCLODEXTRINS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-10-07 US disclosed
EP-0172360-A2 Cyclohexanecarbonitriles and their use as components for liquid crystals F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1986-02-26 EP disclosed
EP-0168683-A2 Liquid crystals with alkenyl or alkenyloxy groups F. HOFFMANN-LA ROCHE AG (CH) 1986-01-22 EP disclosed
EP-0163433-A2 Antibacterial solid composition for oral administation Takeda Chemical Industries, Ltd. (JP) 1985-12-04 EP disclosed
EP-0100966-A1 Carbamic-acid esters, their preparation and their use in pest control BAYER AG (DE) 1984-02-22 EP disclosed
US-RE30456-E ANTIFERTILITY AGENTS, ANTIINFLAMATORY AGENTS AND CENTRAL NERVOUS SYSTEM DEPRESSANTS GRUPPO LEPETIT S.P.A. (IT) 1980-12-23 US disclosed
US-4075341-A 2-Substituted phenyl-5-triazols [5,1-a] isoquinoline compounds GRUPPO LEPETIT S.P.A. (IT) 1978-02-21 US disclosed