SCHEMBL861017

SCHEMBL861017

C=C(C)C(=O)OC#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
SCHEMBL9512912 0.87 ALDH1A1 (0.52)
SCHEMBL20215517 0.82 ALDH1A1 (0.39)
SCHEMBL22973794 0.78
SCHEMBL29801757 0.77 TSHR (0.32)
SCHEMBL11964228 0.76 ALDH1A1 (0.42)
SCHEMBL9189718 0.76
SCHEMBL10963979 0.75 ALDH1A1 (0.41)
SCHEMBL18628719 0.74
SCHEMBL441758 0.74
SCHEMBL2448615 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3861039-B1 HYDROGEL COMPOSITIONS OPHTALMIC CIE (FR) 2023-11-01 EP claimed
CN-114377727-B Embedding type metal catalyst 安徽壹石通材料科学研究院有限公司 2023-08-01 CN claimed
CN-115782470-A Self-sealing tire and preparation process thereof 洛克优(上海)新材料科技有限责任公司 2023-03-14 CN claimed
CN-113861656-B Preparation method of polycarbonate insulating material 株洲地博光电材料有限公司 2022-12-27 CN claimed
CN-115198517-A High-hardness environment-friendly needled carpet and processing technology thereof 安洁利德科技(江苏)有限公司 2022-10-18 CN claimed
CN-115044268-A Preparation method of tire inner attached coating with double crosslinking function 洛克优(上海)新材料科技有限责任公司 2022-09-13 CN 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
EP-3861039-A1 HYDROGEL COMPOSITIONS Ophtalmic Compagnie (FR) 2021-08-11 EP claimed
EP-2371782-B1 Cartridge or foil pouch containing a chemical two-component mortar composition with improved adhesion to the surface of semi-purified and/or wet bore holes in mineral base and use of same HILTI AG (LI) 2021-06-23 EP claimed
EP-0436449-B1 Magnetisable microspheres based on polysilsesquioxane, their preparation process and their biological use RHONE POULENC CHIMIE (FR) 1994-03-16 EP claimed
EP-0406664-B1 ADHESIVE SILICONE COMPOSITIONS TOSHIBA SILICONE CO., LTD. (JP) 1993-03-31 EP claimed
EP-0185873-B1 MOULDING MASSES BASED ON ACRYLATES HÜLS AKTIENGESELLSCHAFT (DE) 1991-09-04 EP claimed
EP-0436449-A1 Magnetisable microspheres based on polysilsesquioxane, their preparation process and their biological use SOCIETE PROLABO (FR) 1991-07-10 EP claimed
EP-0250205-B1 REACTION PRODUCT OF PHOSPHATE-ESTER AND ALKOXYSILAN DOW CORNING CORPORATION (US) 1990-07-18 EP claimed
EP-0069133-B2 PHOTO SETTING COMPOSITION FOR COATING SUBSTRATES WITH AN ABRASION-RESISTANT TRANSPARENT OR TRANSLUCENT FILM BATTELLE DEVELOPMENT CORPORATION (US) 1990-04-11 EP claimed
EP-0159894-B1 THERMOSET ACRYLIC RESIN COMPOSITION FOR COATING METALLIC MATERIALS AND STAINLESS STEEL COATED WITH THE COMPOSITION Chisso Corporation (JP) 1989-10-04 EP claimed
EP-0118527-B1 A METHOD OF MAKING AN ABRASION RESISTANT COATING ON A SOLID SUBSTRATE AND ARTICLES PRODUCED THEREBY FOSTER GRANT CORPORATION (US) 1989-02-15 EP claimed
EP-0161830-B1 SILOXANE PHOTOINITIATORS WITH ARYOYL FORMATE GROUPS LOCTITE CORPORATION (US) 1988-09-21 EP claimed
EP-0107764-B1 CASTING RESINS BASED ON ESTERS OF ACRYLIC ACID HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) 1987-03-18 EP claimed