SCHEMBL4435865

SCHEMBL4435865

C[Ti](C)(C)C1=CC=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 SCHEMBL6344137 0.97
SCHEMBL8989644 0.97
Hydrochloric Acid SCHEMBL5898864 0.97
Hydrochloric Acid SCHEMBL8157594 0.97
Chloromethane SCHEMBL8158491 0.95
Dimethylamine SCHEMBL6351204 0.92
Isopropyl Alcohol SCHEMBL6353297 0.88
SCHEMBL9190045 0.84
SCHEMBL1821647 0.82
SCHEMBL7717905 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 238 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119662197-A Organic silica gel and preparation method and application thereof 苏州桐力光电股份有限公司 2025-03-21 CN claimed
CN-109651039-B Method for synthesizing chiral citronellal from methylheptenone 万华化学集团股份有限公司 2022-08-05 CN claimed
CN-109651039-A A kind of method of methyl heptenone synthesis of chiral citronellal 万华化学集团股份有限公司 2019-04-19 CN claimed
US-6277934-B1 A SYNDIOTACTIC HOMO- OR COPOLYMER FROM A STYRENIC COMPOUND IN THE PRESENCE OF A METALLOCENE OF HIGH, STABLE ACTIVITY COMPRISING A TITANIUM COMPOUND AND AN ORGANIC ALUMINOXY COMPOUND OF SPECIFIC NUCLEAR MAGNETIC RESONANCE SPECTRUM IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-08-21 US claimed
EP-1101774-A1 Multi-metallic metallocene catalysts for polymerization of styrene and method of polymerization using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2001-05-23 EP claimed
US-5767217-A Process for the preparation of polyorganosiloxanes containing unsaturated functions, by dehydrogenative condensation in the presence of titanium, zirconium or hafnium RHONE-POULENC CHIMIE (FR) 1998-06-16 US claimed
EP-0717757-B1 METHOD FOR THE PREPARATION OF POLYORGANOSILOXANES WITH INSATURATED FUNCTIONS BY DEHYDROGENOCONDENSATION IN THE PRESENCE OF COMPLEXES OF TITANIUM, ZIRKONIUM OR HAFNIUM RHONE POULENC CHIMIE (FR) 1997-12-17 EP claimed
EP-0717757-A1 METHOD FOR THE PREPARATION OF POLYORGANOSILOXANES WITH INSATURATED FUNCTIONS BY DEHYDROGENOCONDENSATION IN THE PRESENCE OF COMPLEXES OF TITANIUM, ZIRKONIUM OR HAFNIUM RHONE-POULENC CHIMIE (FR) 1996-06-26 EP claimed
EP-0420134-B1 Process for producing styrene polymers IDEMITSU KOSAN CO (JP) 1996-02-07 EP claimed
US-5420089-A Titanium compound, alkylaluminoxane, polyhydroxy compound IDEMITSU KOSAN CO., LTD. (JP) 1995-05-30 US claimed
US-5420240-A Process for purification of syndiotactic styrene polymer IDEMITSU KOSAN CO., LTD. (JP) 1995-05-30 US claimed
WO-1995007312-A1 METHOD FOR THE PREPARATION OF POLYORGANOSILOXANES WITH INSATURATED FUNCTIONS BY DEHYDROGENOCONDENSATION IN THE PRESENCE OF COMPLEXES OF METALS OF GROUP IV RHONE-POULENC CHIMIE (FR) 1995-03-16 WO claimed
US-5340892-A Addition polymerization in presence of a polymerization catalysts mixture consisting of a cyclopentadienyl titanium compound and an alkylaluminoxane to provide a wide molecular weight distribution IDEMITSU KOSAN CO., LTD. (JP) 1994-08-23 US claimed
US-5276117-A Titanium compound, alkylaluminoxane and an organic polyhydroxy compound catalyst IDEMITSU KOSAN CO., LTD. (JP) 1994-01-04 US claimed
US-5023304-A Using coordination catalyst; highly syndiotactic IDEMITSU KOSAN CO., LTD. (JP) 1991-06-11 US claimed
EP-0420134-A2 Process for producing styrene polymers IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-04-03 EP claimed
JP-3119006-A None JP disclosed
JP-7033821-A None JP disclosed
EP-0322731-A2 Vinylcyclohexane-based polymers and process for production thereof IDEMITSU KOSAN COMPANY LIMITED (JP) 1989-07-05 EP disclosed
EP-0311099-A2 Styrene copolymer and process for producing said copolymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1989-04-12 EP disclosed