SCHEMBL546952

SCHEMBL546952

C=CC(C)(C)CCCC

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
SCHEMBL1285182 0.92 TSHR (0.40)
SCHEMBL28367093 0.90 TSHR (0.44)
SCHEMBL22807004 0.90 TSHR (0.44)
SCHEMBL28142377 0.90 TSHR (0.44)
SCHEMBL5142088 0.90 TSHR (0.44)
Hydrochloric Acid SCHEMBL28154625 0.85 TSHR (0.41)
SCHEMBL633249 0.82
SCHEMBL6902592 0.78 TSHR (0.39)
SCHEMBL8960724 0.78
SCHEMBL6931273 0.76 MEN1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7875285-B1 n acrylic ester polymer including a drug having anovercoating of a different acrylic ester polymer having a glass transition temperature of 35-50 degrees C. to control elution of the drug; temperature change morphology of drug polymer to change and increase release; thrombolytic agents; restenosis ADVANCED CARDIOVASCULAR SYSTEMS, INC. (US) 2011-01-25 US claimed
WO-2005012209-A2 CATALYZED ENANTIOSELECTIVE TRANSFORMATION OF ALKENES UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2005-02-10 WO claimed
WO-2025217099-A1 INHIBITORS FOR HYDROGEN EMBRITTLEMENT AND METHODS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2025-10-16 WO disclosed
US-12049597-B2 High octane synthetic fuels ALLIANCE FOR SUSTAINABLE ENERGY, LLC (US) 2024-07-30 US disclosed
WO-2022107511-A1 PHENOL COMPOUND, ELECTROCONDUCTIVE PASTE COMPOSITION, METHOD FOR PRODUCING ELECTROCONDUCTIVE PASTE COMPOSITION, AND ELECTROCONDUCTIVE WIRING LINE AND PRODUCTION METHOD THEREFOR 信越化学工業株式会社 2022-05-27 WO disclosed
US-20210207048-A1 HIGH OCTANE SYNTHETIC FUELS Alliance for Energy Innovation, LLC 2021-07-08 US disclosed
US-9303111-B2 Acrylate-olefin copolymers, methods for producing same and compositions utilizing same LUBRIZOL ADVANCED MATERIALS, INC. (US) 2016-04-05 US disclosed
CN-105367913-A Car corrugated pipe TPV (thermoplastic vulcanizate) material and preparation method thereof ANHUI XIONGYA PLASTIC TECH CO LTD 2016-03-02 CN disclosed
CN-105367911-A Auto part rubber coating TPV and preparation method thereof ANHUI XIONGYA PLASTIC TECH CO LTD 2016-03-02 CN disclosed
US-20140275460-A1 Acrylate-Olefin Copolymers, Methods For Producing Same And Compositions Utilizing Same LUBRIZOL ADVANCED MATERIALS, INC. (US) 2014-09-18 US disclosed
EP-2773679-A1 ACRYLATE-OLEFIN COPOLYMERS, METHODS FOR PRODUCING SAME AND COMPOSITIONS UTILIZING SAME Lubrizol Advanced Materials, Inc. (US) 2014-09-10 EP disclosed
EP-0003795-B1 PROCESS FOR PREPARING N-SUBSTITUTED CARBOXYLIC ACID AMIDES BASF Aktiengesellschaft (DE) 1981-10-14 EP disclosed
EP-0009077-B1 SUBSTITUTED PHENYLPROPYL HALIDES, THEIR PREPARATION AND USE BASF Aktiengesellschaft (DE) 1981-09-30 EP disclosed
US-4273938-A REACTING CYANO COMPOUNDS WITH OLEFINS AND WATER IN THE PRESENCE OF CATION EXCHANGE RESINS CONTAINING SULFONIC ACID GROUPS BASF AKTIENGESELLSCHAFT (DE) 1981-06-16 US disclosed
US-4250123-A CHEMICAL INTERMEDIATES FOR FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1981-02-10 US disclosed
US-4202199-A Manufacture of alkylphenol compounds BASF AKTIENGESELLSCHAFT (DE) 1980-05-13 US disclosed
US-4198531-A Manufacture of p-alkylphenols BASF AKTIENGESELLSCHAFT (DE) 1980-04-15 US disclosed
EP-0009077-A1 Substituted phenylpropyl halides, their preparation and use BASF Aktiengesellschaft (DE) 1980-04-02 EP disclosed
EP-0003795-A1 Process for preparing N-substituted carboxylic acid amides BASF Aktiengesellschaft (DE) 1979-09-05 EP disclosed
US-4138591-A Manufacture of alkylphenols BASF AKTIENGESELLSCHAFT (DE) 1979-02-06 US disclosed