Butadiene

Butadiene

SCHEMBL83948

C=CC=C.CC1=C(C)C([Ti](C)(C)NC(C)(C)C)c2ccccc21.[SiH4]

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 SCHEMBL6885291 1.00
SCHEMBL821476 0.93
Butadiene SCHEMBL7592871 0.93
SCHEMBL87654 0.89
Butadiene SCHEMBL8524026 0.87 GPR3 (0.31)
SCHEMBL7867045 0.85 MAOB (0.34)
Butadiene SCHEMBL7127260 0.81
SCHEMBL4558375 0.79 GPR3 (0.35)
SCHEMBL28973379 0.77 GPR3 (0.36)
Butadiene SCHEMBL84577 0.76

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-7217676-B2 Hydrophobization and silica for supported catalyst EXXON MOBIL CHEMICAL PATENTS INC. (US) 2007-05-15 US claimed
US-20050159299-A1 Hydrophobization and silica for supported catalyst EXXONMOBIL CHEMICAL PATENTS INC. 2005-07-21 US claimed
EP-3519456-B1 CAPPED MULTI- OR DUAL-HEADED COMPOSITIONS USEFUL FOR CHAIN SHUTTLING AND PROCESS TO PREPARE THE SAME DOW GLOBAL TECHNOLOGIES LLC (US) 2024-07-03 EP disclosed
EP-3519455-B1 MULTI- OR DUAL-HEADED COMPOSITIONS USEFUL FOR CHAIN SHUTTLING AND PROCESS TO PREPARE THE SAME DOW GLOBAL TECHNOLOGIES LLC (US) 2024-04-10 EP disclosed
EP-3596138-B1 CATALYST SYSTEM FOR MULTI-BLOCK COPOLYMER FORMATION DOW GLOBAL TECHNOLOGIES LLC (US) 2024-04-03 EP disclosed
US-11897992-B2 Catalyst system for multi-block copolymer formation DOW GLOBAL TECHNOLOGIES LLC (US) 2024-02-13 US disclosed
US-20230406985-A1 PREPARATION OF POLYOLEFIN-POLYACRYLATE BLOCK COPOLYMERS ADDITIVES FOR INCREASING SURFACE ENERGY OF POLYETHYLENE DOW GLOBAL TECHNOLOGIES LLC (US) 2023-12-21 US disclosed
US-20230399450-A1 PREPARATION OF NON-POLAR-POLAR BLOCK COPOLYMERS VIA VINYL-TERMINATED POLYOLEFINS DOW GLOBAL TECHNOLOGIES LLC (US) 2023-12-14 US disclosed
US-20230183401-A1 ALKENE FUNCTIONALIZED ACTIVATORS AND THEIR USE IN ELECTRICAL APPLICATIONS DOW GLOBAL TECHNOLOGIES LLC (US) 2023-06-15 US disclosed
US-20230174693-A1 OLEFIN POLYMERIZATION BIMETALLIC ACTIVATORS DOW GLOBAL TECHNOLOGIES LLC (US) 2023-06-08 US disclosed
EP-3596143-B1 CATALYST SYSTEM FOR MULTI-BLOCK COPOLYMER FORMATION DOW GLOBAL TECHNOLOGIES LLC (US) 2023-04-26 EP disclosed
EP-0863919-B1 SUPPORTED CATALYST CONTAINING TETHERED CATION FORMING ACTIVATOR DOW CHEMICAL CO (US) 2000-11-15 EP disclosed
EP-0889911-B1 METALLOCENE COCATALYST DOW CHEMICAL CO (US) 2000-11-02 EP disclosed
US-6121185-A A CATALYST USEFUL FOR POLYMERIZATION OF ADDITION POLYMERIZABLE MONOMERS COMPRISING A GROUP 4 METAL COMPLEX AND A CATALYST AND A CATALYST ACTIVATOR COMPRISING BRONSTED ACID CATION CAPABLE OF DONATING A PROTON AND AN INERT ANION THE DOW CHEMICAL COMPANY (US) 2000-09-19 US disclosed
EP-0889912-B1 HIGHLY SOLUBLE OLEFIN POLYMERIZATION CATALYST ACTIVATOR DOW CHEMICAL CO (US) 2000-07-12 EP disclosed
US-6087293-A CATALYST SUPPORT COMPRISING AN INORGANIC OXIDE SURFACE MODIFIED WITH A FUNCTIONALIZED SILANE WHICH IS BONDED TO AN ANIONIC COMPOUND, THE ANION COMPATIBLE WITH A CATION CAPABLE OF REACTING WITH A METAL COMPOUND TO FORM A CATALYTIC COMPLEX THE DOW CHEMICAL COMPANY (US) 2000-07-11 US disclosed
US-5977251-A Non-adiabatic olefin solution polymerization THE DOW CHEMICAL COMPANY (US) 1999-11-02 US disclosed
US-5919983-A COMPRISING A CATION WHICH IS A BRONSTED ACID CAPABLE OF DONATING A PROTON AND AN INERT, COMPATIBLE, NONCOORDINATING ANION THE DOW CHEMICAL COMPANY (US) 1999-07-06 US disclosed
US-5883204-A ADDING AN IONIC CATALYST ACTIVATOR TO A SOLUTION OLEFIN POLYMERIZATION REACTION THE DOW CHEMICAL COMPANY (US) 1999-03-16 US disclosed
US-5814714-A INTERPOLYMER COMPRISING POLYMERIZED ETHYLENE, ALPHA-OLEFIN, NON-CONJUGATED ALPHA,OMEGA DIENE THE DOW CHEMICAL COMPANY (US) 1998-09-29 US disclosed