SCHEMBL88549

SCHEMBL88549

C=CCC(CN)C(=O)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
SCHEMBL891727 0.85 GRIK1 (0.64)
SCHEMBL6050002 0.82 GRIK1 (0.75)
SCHEMBL14518785 0.82 GRIK1 (0.57)
SCHEMBL1045275 0.82 GRIK1 (0.57)
SCHEMBL13258636 0.82 GRIK1 (0.57)
Stearic Acid SCHEMBL11392170 0.81 PPARG (0.53)
SCHEMBL6834831 0.79 CPB2 (0.57)
SCHEMBL21245478 0.78 GRIK1 (0.44)
SCHEMBL10625605 0.78
SCHEMBL10435758 0.77 GRIK1 (0.57)

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

Appears in 2791 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230329994-A1 Surfactant Containing Formulation of Pseudo-Ceramides SYMRISE AG (DE) 2023-10-19 US claimed
WO-2023177688-A1 FIRE-RETARDANT FOAM CONCENTRATES KINETIC FOAM ENGINEERING INTERNATIONAL, LLC (US) 2023-09-21 WO claimed
CN-116441052-A Fluorite type rare earth ore and rare earth fluorite synchronous recovery medicament and use method thereof 中国地质科学院矿产综合利用研究所 2023-07-18 CN claimed
CN-116367814-A Styling shampoo compositions 巴斯夫欧洲公司 2023-06-30 CN claimed
CN-116348086-A Surfactant-containing formulations of ceramide 西姆莱斯股份公司 2023-06-27 CN claimed
EP-3986365-A1 SURFACTANT CONTAINING FORMULATION OF PSEUDO-CERAMIDES Symrise AG (DE) 2022-04-27 EP claimed
CN-114375953-A Reverse osmosis/nanofiltration bactericide suitable for alkaline water and preparation method thereof 上海丰信环保科技有限公司 2022-04-22 CN claimed
CN-112294678-A Sterilization hand sanitizer 田贤明 2021-02-02 CN claimed
CN-112294692-A Frosted hand sanitizer 林楷敏 2021-02-02 CN claimed
CN-112274440-A Colorful hand sanitizer 田贤明 2021-01-29 CN claimed
CN-1406310-A Frother for use in coal reservoirs SOFITECH NV (BE) 2003-03-26 CN claimed
JP-2002500671-A US HEALTH (US) 2002-01-08 JP claimed
CN-1328444-A Preparation of aqueous-based cleaning agents which form vesicles and which contain active agents, method for their production and their utilization MERZ & CO GMBH & CO (DE) 2001-12-26 CN claimed
EP-1104451-A1 ACIDIC HARD SURFACE CLEANING AND DISINFECTING COMPOSITIONS Reckitt Benckiser Inc. (US) 2001-06-06 EP claimed
CN-1278161-A Hair styling compositions PROCTER & GAMBLE (US) 2000-12-27 CN claimed
EP-0986393-A1 THE USE OF A NITROXIDE OR A PRODRUG THEREOF IN THE PROPHYLACTIC AND THERAPEUTIC TREATMENT OF CANCER THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2000-03-22 EP claimed
WO-2000009643-A1 ACIDIC HARD SURFACE CLEANING AND DISINFECTING COMPOSITIONS RECKITT BENCKISER INC. (US) 2000-02-24 WO claimed
WO-1998053835-A1 THE USE OF A NITROXIDE OR A PRODRUG THEREOF IN THE PROPHYLACTIC AND THERAPEUTIC TREATMENT OF CANCER THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-12-03 WO claimed
US-5262089-A Adding an oil in water emulsion with unsaturated fatty ester, ethoxylated alkylphenol and esters of mono-, di-, or trihydric alcohols and fatty acid and amphoteric compounds SANDOZ LTD. (CH) 1993-11-16 US claimed
US-4552685-A ADDITION COPOLYMERS, CLARITY THE DOW CHEMICAL COMPANY (US) 1985-11-12 US claimed