Butadiene

Butadiene

SCHEMBL2133137

C=C(C)C#N.C=CC=C

nearest known ligand 0.00

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⚠ 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
Butadiene SCHEMBL28152965 0.94 TDP1 (0.65)
Butadiene SCHEMBL27568645 0.91 TDP1 (0.61)
Acrylonitrile SCHEMBL11808927 0.91 TDP1 (0.61)
Butadiene SCHEMBL28286276 0.91 TDP1 (0.61)
SCHEMBL28215697 0.87
Propene SCHEMBL28139792 0.87
Butadiene SCHEMBL11805947 0.87 TDP1 (0.55)
SCHEMBL14868 0.86
Water SCHEMBL11786429 0.86
SCHEMBL9859678 0.86 TDP1 (1.00)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250223438-A1 THERMOPLASTIC RESIN COMPOSITION AND MOLDED BODY CONTAINING SAME HYUNDAI MOTOR COMPANY (KR) 2025-07-10 US claimed
CN-114106246-B Method for removing noble metal catalyst from unsaturated copolymer hydrogenation solution 中国石油化工股份有限公司 2024-07-02 CN claimed
CN-116041621-B Hydrogenated nitrile rubber and preparation method thereof 中国石油化工股份有限公司 2023-08-01 CN claimed
CN-116041621-A Hydrogenated nitrile rubber and preparation method thereof 中国石油化工股份有限公司 2023-05-02 CN claimed
CN-116041569-A Hydrogenated nitrile rubber and preparation method thereof 中国石油化工股份有限公司 2023-05-02 CN claimed
CN-114426588-A Method for removing noble metal catalyst from unsaturated copolymer hydrogenation solution 中国石油化工股份有限公司 2022-05-03 CN claimed
CN-108329489-A Precious metal catalyst agent method is removed in chelating resin and preprocess method and noble metal removal methods and unsaturated copolymer hydrogenating liquid 中国石油化工股份有限公司 2018-07-27 CN claimed
CN-108329488-A Precious metal catalyst agent method is removed in chelating resin and preprocess method and noble metal removal methods and unsaturated copolymer hydrogenating liquid 中国石油化工股份有限公司 2018-07-27 CN claimed
EP-2881408-B1 Styrene-based copolymer and thermoplastic resin composition including the same LOTTE ADVANCED MAT CO LTD (KR) 2017-09-20 EP claimed
CN-105622783-A Preparation method of copolymer CHINA PETROLEUM & CHEM CORP 2016-06-01 CN claimed
EP-0455154-A1 Polymer hydrogenation process using ruthenium complexes UNIVERSITY OF WATERLOO (CA) 1991-11-06 EP claimed
US-5057581-A Ruthenium carbonyl complexes containing phosphine ligands used as hydrogenation catalysts UNIVERSITY OF WATERLOO (CA) 1991-10-15 US claimed
US-4816525-A RUTHENIUM CARBONYL PHOSPHINE HYDROGENATION CATALYSTS UNIVERSITY OF WATERLOO (CA) 1989-03-28 US claimed
US-4503196-A SELECTIVE, CONJUGATED DIENE COPOLYMER, RHODIUM COMPLEX CATALYST POLYSAR LIMITED (CA) 1985-03-05 US claimed
US-4464515-A DIENE COPOLYMER; RHODIUM HYDRIDE/LIGAND COMPOUND CATALYST, SOLVENT POLYSAR LIMITED (CA) 1984-08-07 US claimed
US-4152308-A SILICEOUS FILLED VULCANIZATES POLYSAR LIMITED (CA) 1979-05-01 US claimed
US-4150015-A MONOAZO OR AZO-METHINE DYES REACTED WITH A 2-(CYCLOPENTAN-1-ON-2-YLIDENE)CHROMAN COMPOUND POLYSAR LIMITED (CA) 1979-04-17 US claimed
US-4150014-A HYDROXYL HYDROCARBYL POLYMER, AMINE, SHEARING POLYSAR LIMITED (CA) 1979-04-17 US claimed
US-4070325-A DISPERSANTS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1978-01-24 US claimed
US-3965230-A Process of manufacturing lacquered articles of cold rolled abs resin MONSANTO COMPANY (US) 1976-06-22 US claimed