Butadiene

Butadiene

SCHEMBL6885291

C=CC=C.CC1=C(C)C([Ti](C)(C)NC(C)(C)C)c2ccccc21.CC1=C(C)C([Ti](C)(C)NC(C)(C)C)c2ccccc21.[SiH4].[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 SCHEMBL83948 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040038022-A1 Method of making a polypropylene fabric having high strain rate elongation and method of using the same MAUGANS REXFORD A (US) 2004-02-26 US disclosed
US-6482896-B2 FIBERS; BLEND OF POLYPROPYLENE AND ETHYLENE COPOLYMER DOW GLOBAL TECHNOLOGIES INC. 2002-11-19 US disclosed
US-20020019490-A1 Polypropylene/ethylene polymer fiber having improved bond performance and composition for making the same THE DOW CHEMICAL COMPANY 2002-02-14 US disclosed
US-6281289-B1 CONTROLLING CONCENTRATION THE DOW CHEMICAL COMPANY 2001-08-28 US disclosed