SCHEMBL821476

SCHEMBL821476

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

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
Butadiene SCHEMBL6885291 0.93
SCHEMBL87654 0.93
Butadiene SCHEMBL83948 0.93
SCHEMBL7867045 0.88 MAOB (0.34)
Butadiene SCHEMBL7592871 0.86
SCHEMBL4558375 0.85 GPR3 (0.35)
SCHEMBL28973379 0.83 GPR3 (0.36)
SCHEMBL8522938 0.78 POLB (0.33)
Butadiene SCHEMBL8524026 0.78 GPR3 (0.31)
SCHEMBL8523391 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1704171-A2 HYDROPHOBIZATION AND SILICA FOR SUPPORTED CATALYST ExxonMobil Chemical Patents Inc. (US) 2006-09-27 EP claimed
WO-2005075526-A2 HYDROPHOBIZATION AND SILICA FOR SUPPORTED CATALYST EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-08-18 WO claimed
EP-0889911-A1 METALLOCENE COCATALYST THE DOW CHEMICAL COMPANY (US) 1999-01-13 EP claimed
WO-1997036937-A1 METALLOCENE COCATALYST THE DOW CHEMICAL COMPANY (US) 1997-10-09 WO claimed
EP-3774942-A1 OLEFIN POLYMERIZATION ACTIVATORS Dow Global Technologies LLC (US) 2021-02-17 EP disclosed
EP-3774941-A1 BINUCLEAR OLEFIN POLYMERIZATION ACTIVATORS Dow Global Technologies LLC (US) 2021-02-17 EP disclosed
EP-3768686-A1 SILICON-TERMINATED ORGANO-METAL COMPOUNDS AND PROCESSES FOR PREPARING THE SAME Dow Global Technologies, LLC (US) 2021-01-27 EP disclosed
WO-2019190925-A1 BINUCLEAR OLEFIN POLYMERIZATION ACTIVATORS DOW GLOBAL TECHNOLOGIES LLC (US) 2019-10-03 WO disclosed
WO-2019191098-A1 OLEFIN POLYMERIZATION ACTIVATORS DOW GLOBAL TECHNOLOGIES LLC (US) 2019-10-03 WO disclosed
WO-2019182988-A1 SILICON-TERMINATED ORGANO-METAL COMPOUNDS AND PROCESSES FOR PREPARING THE SAME DOW GLOBAL TECHNOLOGIES LLC (US) 2019-09-26 WO disclosed
EP-3519456-A1 CAPPED MULTI- OR DUAL-HEADED COMPOSITIONS USEFUL FOR CHAIN SHUTTLING AND PROCESS TO PREPARE THE SAME DOW GLOBAL TECHNOLOGIES LLC (US) 2019-08-07 EP disclosed
EP-3519455-A1 MULTI- OR DUAL-HEADED COMPOSITIONS USEFUL FOR CHAIN SHUTTLING AND PROCESS TO PREPARE THE SAME DOW GLOBAL TECHNOLOGIES LLC (US) 2019-08-07 EP disclosed
EP-0863924-A1 MONO-OLEFIN/POLYENE INTERPOLYMERS, METHOD OF PREPARATION, COMPOSITIONS CONTAINING THE SAME, AND ARTICLES MADE THEREOF THE DOW CHEMICAL COMPANY (US) 1998-09-16 EP disclosed
EP-0863919-A1 SUPPORTED CATALYST CONTAINING TETHERED CATION FORMING ACTIVATOR THE DOW CHEMICAL COMPANY (US) 1998-09-16 EP disclosed
WO-1997043294-A1 YTTRIUM CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1997-11-20 WO disclosed
WO-1997036937-A1 METALLOCENE COCATALYST THE DOW CHEMICAL COMPANY (US) 1997-10-09 WO disclosed
WO-1997035893-A1 HIGHLY SOLUBLE OLEFIN POLYMERIZATION CATALYST ACTIVATOR THE DOW CHEMICAL COMPANY (US) 1997-10-02 WO disclosed
WO-1997035892-A1 SOLUTION POLYMERIZATION PROCESS WITH DISPERSED CATALYST ACTIVATOR THE DOW CHEMICAL COMPANY (US) 1997-10-02 WO disclosed
WO-1997019965-A1 MONO-OLEFIN/POLYENE INTERPOLYMERS, METHOD OF PREPARATION, COMPOSITIONS CONTAINING THE SAME, AND ARTICLES MADE THEREOF THE DOW CHEMICAL COMPANY (US) 1997-06-05 WO disclosed
WO-1997019959-A1 SUPPORTED CATALYST CONTAINING TETHERED CATION FORMING ACTIVATOR THE DOW CHEMICAL COMPANY (US) 1997-06-05 WO disclosed