SCHEMBL6862666

SCHEMBL6862666

CC1=C(C)C(C)=C([Zr](C2=CC=CC2)[SiH](c2ccccc2)c2ccccc2)C1.c1ccc(CCc2ccccc2)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
Hydrochloric Acid SCHEMBL6753598 0.91
SCHEMBL6871024 0.88
SCHEMBL6866022 0.78 ALDH1A1 (0.33)
SCHEMBL16239567 0.78
Hydrochloric Acid SCHEMBL815948 0.77
SCHEMBL6858973 0.76
SCHEMBL7065724 0.76
SCHEMBL6865086 0.75
Hydrochloric Acid SCHEMBL7060703 0.74
Hydrochloric Acid SCHEMBL10457472 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6713574-B2 POLYMERIZING ETHYLENE, ALPHA-OLEFIN AND DIENE WITH A ZIRCONIUM METALLOCENE CATALYST HAVING AN UNSUBSTITUTED CYCLOPENTADIENYL LIGAND, A MULTIPLY SUBSTITUTED CYCLOPENTADIENYL LIGAND, THAT ARE BRIDGED WITH A GROUP 14 ELEMENT EXXONMOBIL CHEMICAL PATENTS INC. 2004-03-30 US disclosed
EP-1056792-B1 ETHYLENE COPOLYMERIZATION PROCESS EXXONMOBIL CHEM PATENTS INC (US) 2003-07-23 EP disclosed
US-20030060578-A1 Ethylene copolymerization process EXXONMOBIL CHEMICAL PATENTS, INC. 2003-03-27 US disclosed
US-6486278-B1 Ethylene copolymerization process EXXONMOBIL CHEMICAL PATENTS INC. 2002-11-26 US disclosed
EP-1056792-A1 ETHYLENE COPOLYMERIZATION PROCESS EXXON CHEMICAL PATENTS INC. (US) 2000-12-06 EP disclosed
WO-1999041294-A1 ETHYLENE COPOLYMERIZATION PROCESS EXXON CHEMICAL PATENTS INC. (US) 1999-08-19 WO disclosed