SCHEMBL4356579

SCHEMBL4356579

C[C]=O.O=[Ti]

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
SCHEMBL2552774 0.87
SCHEMBL1561 0.87
SCHEMBL1240312 0.80
SCHEMBL15284983 0.80
SCHEMBL6749758 0.80
SCHEMBL25405176 0.80
SCHEMBL225541 0.80
SCHEMBL21409672 0.80
SCHEMBL22092371 0.80
SCHEMBL3776942 0.80

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
EP-1391003-B1 NON-AQUEOUS ELECTROLYTE ADDITIVE FOR IMPROVING SAFETY AND LITHIUM ION SECONDARY BATTERY COMPRISING THE SAME LG CHEMICAL LTD (KR) 2016-07-13 EP disclosed
EP-1391003-A4 NON-AQUEOUS ELECTROLYTE ADDITIVE FOR IMPROVING SAFETY AND LITHIUM ION SECONDARY BATTERY COMPRISING THE SAME LG CHEMICAL LTD (KR) 2009-01-14 EP disclosed
US-7217477-B2 Organometallic compound which decomposes when overvoltage is applying LG CHEM, LTD. (KR) 2007-05-15 US disclosed
US-6881870-B2 Process for producing adamantanol and adamantanone IDEMITSU KOSAN CO., LTD. (JP) 2005-04-19 US disclosed
US-20040199022-A1 Process for producing adamantanol and adamantanone IDEMITSU KOSAN CO. LTD. (JP) 2004-10-07 US disclosed
EP-1408023-A1 PROCESS FOR PRODUCING ADAMANTANOL AND ADAMANTANONE IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-04-14 EP disclosed
EP-1391003-A1 NON-AQUEOUS ELECTROLYTE ADDITIVE FOR IMPROVING SAFETY AND LITHIUM ION SECONDARY BATTERY COMPRISING THE SAME LG Chem, Ltd. (KR) 2004-02-25 EP disclosed
US-20030175596-A1 Organometallic compound which decomposes when overvoltage is applying LG ENERGY SOLUTION, LTD. (KR) 2003-09-18 US disclosed
WO-2002095861-A1 NON-AQUEOUS ELECTROLYTE ADDITIVE FOR IMPROVING SAFETY AND LITHIUM ION SECONDARY BATTERY COMPRISING THE SAME LG CHEM, LTD. (KR) 2002-11-28 WO disclosed
US-5348775-A Forming thin ferroelectric film design by spin-coating surface with aqueous acetic acid solution of lead titanate, lead lanthanum zirconate titanate or lead zirconate titanate; drying; laser annealing; acid washing NORTHERN ILLINOIS UNIVERSITY (US) 1994-09-20 US disclosed
US-5188902-A Lead(lanthanum and(or) zirconium) titantate NORTHERN ILLINOIS UNIVERSITY (US) 1993-02-23 US disclosed