SCHEMBL7176328

SCHEMBL7176328

CC(C)(C)C[Ti](CC(C)(C)C)(CC(C)(C)C)C1=CC=CC1

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
SCHEMBL4463691 0.83
SCHEMBL5888472 0.75
SCHEMBL5888594 0.71
SCHEMBL2399203 0.70
SCHEMBL7607498 0.68
Ammonia Solution, Strong SCHEMBL16835527 0.68
SCHEMBL5888603 0.68
SCHEMBL9190045 0.68
SCHEMBL8384358 0.68
Chloromethane SCHEMBL8158491 0.67

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0502683-B2 Catalyst composition for preparation of syndiotactic vinyl aromatic polymers DOW CHEMICAL CO (US) 2003-04-02 EP disclosed
US-5886117-A Process using borane derived catalysts for preparation of syndiotactic vinyl aromatic polymers THE DOW CHEMICAL COMPANY (US) 1999-03-23 US disclosed
EP-0742226-B1 Process for preparing borane derived catalysts for preparation of syndiotactic vinyl aromatic polymers DOW CHEMICAL CO (US) 1998-12-02 EP disclosed
EP-0742226-A2 Process for preparing borane derived catalysts for preparation of syndiotactic vinyl aromatic polymers THE DOW CHEMICAL COMPANY (US) 1996-11-13 EP disclosed
EP-0502683-B1 Catalyst composition for preparation of syndiotactic vinyl aromatic polymers DOW CHEMICAL CO (US) 1996-07-17 EP disclosed
EP-0421659-B1 Process for preparation of syndiotactic vinyl aromatic polymers DOW CHEMICAL CO (US) 1996-07-10 EP disclosed
EP-0698618-A2 Addition polymerization catalyst with oxidative activation THE DOW CHEMICAL COMPANY (US) 1996-02-28 EP disclosed
US-5321106-A Addition polymerization catalyst with oxidative activation THE DOW CHEMICAL COMPANY (US) 1994-06-14 US disclosed
US-5206197-A CATALYST COMPOSITION FOR PREPARATION OF SYNDIOTACTIC VINYL AROMATIC POLYMERS THE DOW CHEMICAL COMPANY (US) 1993-04-27 US disclosed
EP-0502683-A1 Catalyst composition for preparation of syndiotactic vinyl aromatic polymers THE DOW CHEMICAL COMPANY (US) 1992-09-09 EP disclosed
EP-0468651-A1 Addition polymerization catalyst with oxidative activation THE DOW CHEMICAL COMPANY (US) 1992-01-29 EP disclosed
US-5066741-A Contacting monomers with complex catalyst THE DOW CHEMICAL COMPANY (US) 1991-11-19 US disclosed
EP-0421659-A2 Process for preparation of syndiotactic vinyl aromatic polymers THE DOW CHEMICAL COMPANY (US) 1991-04-10 EP disclosed