SCHEMBL8663013

SCHEMBL8663013

C1=CCC([Zr+2]C2=CC=CC2)=C1.C[O-].C[O-]

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
Hydrochloric Acid SCHEMBL8856964 0.97
Water SCHEMBL29018953 0.94
SCHEMBL27467127 0.92
Fluoride Ion SCHEMBL7641236 0.92
Hydrochloric Acid SCHEMBL124211 0.92
SCHEMBL2191030 0.92
Bromide SCHEMBL618318 0.92
Iodide SCHEMBL8148073 0.92
Water SCHEMBL4251546 0.89
Hydrochloric Acid SCHEMBL1331037 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0540122-A1 Depolymerization of conjugated diene polymers SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1993-05-05 EP claimed
US-5162446-A Contacting polymer with a biscyclopentadienyl zirconium compound SHELL OIL COMPANY (US) 1992-11-10 US claimed
EP-0591756-B1 Polymerization catalysts and process for producing polymers IDEMITSU KOSAN CO (JP) 1998-11-25 EP disclosed
EP-0544304-B1 Catalyst composition for hydrogenating olefinically unsaturated polymers JAPAN SYNTHETIC RUBBER CO LTD (JP) 1998-02-04 EP disclosed
EP-0448115-B1 Method for producing a polyolefin TOSOH CORP (JP) 1998-01-07 EP disclosed
EP-0810238-A1 A process for producing polymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1997-12-03 EP disclosed
EP-0522581-B1 Process for producing olefin based polymers and olefin polymerization catalyst IDEMITSU KOSAN CO (JP) 1997-10-15 EP disclosed
US-5629390-A Method for producing a polyolefin TOSOH CORPORATION (JP) 1997-05-13 US disclosed
US-5461127-A Comprising group 4 metal, cyclic hydrocarbon, ligands, Lewis base; addition polymerization IDEMITSU KOSAN CO., LTD. (JP) 1995-10-24 US disclosed
US-5444134-A Using a coordination catalyst IDEMITSU KOSAN CO., LTD. (JP) 1995-08-22 US disclosed
EP-0434469-B1 Hydrogenation catalyst composition and process for hydrogenating olefinically unsaturated polymer using the same JAPAN SYNTHETIC RUBBER CO LTD (JP) 1995-02-22 EP disclosed
EP-0576213-A2 Process for polymerizing olefins MITSUBISHI CHEMICAL CORPORATION (JP) 1993-12-29 EP disclosed
US-5270274-A Catalyst composition for hydrogenating olefinically unsaturated polymers JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1993-12-14 US disclosed
EP-0544304-A1 Catalyst composition for hydrogenating olefinically unsaturated polymers JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1993-06-02 EP disclosed
EP-0540122-A1 Depolymerization of conjugated diene polymers SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1993-05-05 EP disclosed
EP-0522581-A1 Process for producing olefin based polymers and olefin polymerization catalyst IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-01-13 EP disclosed
US-5169905-A Using a bis(cyclopentadienyl)transition metal compound and an alkali aluminum organic complex as catalyst JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-12-08 US disclosed
US-5162446-A Contacting polymer with a biscyclopentadienyl zirconium compound SHELL OIL COMPANY (US) 1992-11-10 US disclosed
EP-0448115-A2 Method for producing a polyolefin Tosoh Corporation (JP) 1991-09-25 EP disclosed
EP-0434469-A2 Hydrogenation catalyst composition and process for hydrogenating olefinically unsaturated polymer using the same JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1991-06-26 EP disclosed