SCHEMBL3842779

SCHEMBL3842779

CCCCC1=C([Zr]C2=C(CCCC)C=CC2)CC=C1.[H-].[H-]

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
SCHEMBL285710 0.98
Hydrochloric Acid SCHEMBL617595 0.96
Hydrochloric Acid SCHEMBL3907073 0.96
Fluoride SCHEMBL1130835 0.96
Bromide SCHEMBL21410589 0.96
Methane SCHEMBL5838782 0.96
Butane SCHEMBL8674697 0.96
Chloromethane SCHEMBL3691559 0.94
Methoxymethane SCHEMBL28440271 0.94
SCHEMBL813449 0.92 ACHE (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0949278-B2 Polymeric product produced with catalyst comprising an ion pair EXXONMOBIL CHEM PATENTS INC (US) 2009-11-04 EP disclosed
US-7077977-B2 Bulky borate activations EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-07-18 US disclosed
EP-0949279-B1 Process for the preparation of a polymeric product with a catalyst consisting of an ion pair EXXONMOBIL CHEM PATENTS INC (US) 2005-01-05 EP disclosed
US-20040254065-A1 Bulky borate activations EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-16 US disclosed
EP-0949278-B1 Polymeric product produced with catalyst comprising an ion pair EXXONMOBIL CHEM PATENTS INC (US) 2004-11-03 EP disclosed
EP-0558158-B2 Catalysts, method of preparing these catalysts and method of using said catalysts EXXONMOBIL CHEM PATENTS INC (US) 2004-10-06 EP disclosed
EP-1461152-A1 BULKY BORATE ACTIVATORS ExxonMobil Chemical Patents Inc. (US) 2004-09-29 EP disclosed
WO-2003049856-A1 BULKY BORATE ACTIVATORS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-06-19 WO disclosed
EP-0558158-B1 Catalysts, method of preparing these catalysts and method of using said catalysts EXXON CHEMICAL PATENTS INC (US) 2000-08-16 EP disclosed
EP-0949279-A2 Process for the preparation of a polymeric product with a catalyst consisting of an ion pair Exxon Chemical Patents, Inc. (US) 1999-10-13 EP disclosed
EP-0949278-A2 Polymeric product produced with catalyst comprising an ion pair Exxon Chemical Patents, Inc. (US) 1999-10-13 EP disclosed
EP-0468537-B1 Catalysts, method of preparing these catalysts and method of using said catalysts EXXON CHEMICAL PATENTS INC (US) 1996-11-13 EP disclosed
EP-0558158-A1 Catalysts, method of preparing these catalysts and method of using said catalysts EXXON CHEMICAL PATENTS INC. (US) 1993-09-01 EP disclosed
EP-0468537-A1 Catalysts, method of preparing these catalysts and method of using said catalysts EXXON CHEMICAL PATENTS INC. (US) 1992-01-29 EP disclosed
WO-1988005793-A1 CATALYSTS, METHOD OF PREPARING THESE CATALYSTS AND METHOD OF USING SAID CATALYSTS EXXON CHEMICAL PATENTS, INC. (US) 1988-08-11 WO disclosed
EP-0277004-A1 Catalysts, method of preparing these catalysts and method of using said catalysts EXXON CHEMICAL PATENTS INC. (US) 1988-08-03 EP disclosed