SCHEMBL7635325

SCHEMBL7635325

CC(C)(C)C1=CCC([Zr]C2=C(C(C)(C)C)C(C(C)(C)C)=CC2)=C1C(C)(C)C

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
SCHEMBL28229880 0.76
Hydrochloric Acid SCHEMBL9066196 0.74
SCHEMBL930575 0.73
SCHEMBL6192999 0.71
Hydrochloric Acid SCHEMBL6908960 0.70
Hydrochloric Acid SCHEMBL27545163 0.70
Hydrochloric Acid SCHEMBL27545162 0.70
SCHEMBL9308339 0.61
SCHEMBL27812319 0.57
Hydrochloric Acid SCHEMBL8498368 0.56

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6355603-B1 REACTION PRODUCT OF MALEIC ANHYDRIDE AND OLIGOALKENES FORMED BY OLIGOMERIZATION OF LINEAR 1-DECENE IN PRESENCE OF TITANIUM, ZIRCONIUM OR HAFNIUM METALLOCENE CATALYST AND ACTIVATOR BASED ON ORGANOALUMINUM, ORGANOBORON OR CARBOCATIONIC COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2002-03-12 US disclosed
EP-0807096-A1 PROCESS FOR PREPARING OLEFIN OLIGOMERS BASF AKTIENGESELLSCHAFT (DE) 1997-11-19 EP disclosed
WO-1996023751-A1 PROCESS FOR PREPARING OLEFIN OLIGOMERS BASF AKTIENGESELLSCHAFT (DE) 1996-08-08 WO disclosed