SCHEMBL8424618

SCHEMBL8424618

CCC1=C([Zr](C)(C)C)CC=C1

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
SCHEMBL6055376 0.86
SCHEMBL7175220 0.83
SCHEMBL6851049 0.80
SCHEMBL1078721 0.77
SCHEMBL20377460 0.75
SCHEMBL19582482 0.74
SCHEMBL19582481 0.72
SCHEMBL7637545 0.71
SCHEMBL7173370 0.71 HTR3A (0.31)
Hydrochloric Acid SCHEMBL8167049 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-0597961-A4 PROCESS USING BORANE DERIVED CATALYSTS FOR PREPARATION OF SYNDIOTACTIC VINYL AROMATIC POLYMERS. DOW CHEMICAL CO (US) 1995-09-20 EP disclosed
EP-0597961-A1 PROCESS USING BORANE DERIVED CATALYSTS FOR PREPARATION OF SYNDIOTACTIC VINYL AROMATIC POLYMERS THE DOW CHEMICAL COMPANY (US) 1994-05-25 EP disclosed
US-5206197-A CATALYST COMPOSITION FOR PREPARATION OF SYNDIOTACTIC VINYL AROMATIC POLYMERS THE DOW CHEMICAL COMPANY (US) 1993-04-27 US disclosed
WO-1993003067-A1 PROCESS USING BORANE DERIVED CATALYSTS FOR PREPARATION OF SYNDIOTACTIC VINYL AROMATIC POLYMERS THE DOW CHEMICAL COMPANY (US) 1993-02-18 WO disclosed
EP-0502683-A1 Catalyst composition for preparation of syndiotactic vinyl aromatic polymers THE DOW CHEMICAL COMPANY (US) 1992-09-09 EP disclosed
US-5066741-A Contacting monomers with complex catalyst THE DOW CHEMICAL COMPANY (US) 1991-11-19 US disclosed