SCHEMBL6902820

SCHEMBL6902820

CC1(C)C2(C=CC=CC2)C12C=CC=CC2

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
SCHEMBL21273324 0.71
SCHEMBL472871 0.71
SCHEMBL27444047 0.69
SCHEMBL27858829 0.69
Hydrochloric Acid SCHEMBL11048878 0.69
SCHEMBL28231098 0.67
SCHEMBL3828079 0.67
SCHEMBL23631727 0.67
SCHEMBL5530412 0.67
SCHEMBL11242893 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040116733-A1 Composition and compound based on salt (s) of metals and of acid exhibiting a sulfonyl group carried by a perhalogenated carbon and their use as lewis acid RHODIA CHIMIE (FR) 2004-06-17 US disclosed
US-6613945-B1 Resolution method for a racemic mixture of aldehydes RHODIA CHIMIE (FR) 2003-09-02 US disclosed
US-20030162994-A1 6,6'-Bis-(1-Phosphanorbornadiene) diphosphines, their preparation and their uses MATHEY FRANCOIS (FR) 2003-08-28 US disclosed
US-6521795-B2 Minimizing formation of enantiomer with use of catalyst comprising transition metals with chiral ligands RHODIA CHIMIE (FR) 2003-02-18 US disclosed
US-6455738-B1 FRIEDEL-CRAFT CATALYSIS IN THE PRESENCE OF MIXTURES OF LEWIS ACIDS AND SULFONIC ACID ESTERS AS FRIEDEL CRAFT'S CATALYSTS; STOICHIOMETRY RHODIA CHIMIE (FR) 2002-09-24 US disclosed
US-20020072636-A1 Optically active diphosphines, preparation thereof according to a process for the resolution of the racemic mixture and use thereof MATHEY FRANCOIS (FR) 2002-06-13 US disclosed
US-6380412-B1 HYDROGENATION CATALYSTS RHONE-POULENC CHIMIE (FR) 2002-04-30 US disclosed
US-20020042540-A1 New 6,6'-bis-(1-phosphanorbornadiene) diphosphines, their preparation and their uses MATHEY FRANCOIS (FR) 2002-04-11 US disclosed
US-6340775-B1 FORMING ALCOHOLS BY REDUCTION OF CARBONYL COMPOUNDS IN THE PRESENCE OF CATALYSTS RHODIA CHIMIE (FR) 2002-01-22 US disclosed
US-6288279-B1 THEIR PREPARATION PROCESS AND THEIR USE IN ASYMMETRICAL CATALYSIS. REARRANGING A DIPHOSPHOLE, REACTING THE DIPHOSPHOLE WITH AN ACETYLENIC COMPOUND TO FORM THE DIPHOSPHINE RHODIA CHIMIE (FR) 2001-09-11 US disclosed
US-6166257-A METAL COMPLEX OF AN OPTICALLY ACTIVE BIS(1-PHOSPHA-2,3-DIPHENYL-4,5-DIMETHYLNORBORNADIENE) RHODIA CHIMIE (FR) 2000-12-26 US disclosed
US-6037493-A Optically active diphosphines, preparation thereof according to a process for the resolution of the racemic mixture and use thereof RHONE-POULENC CHIMIE (FR) 2000-03-14 US disclosed
US-5783738-A Optically active diphosphines, preparation thereof according to a process for the resolution of the racemic mixture and use thereof RHONE-POULENC CHIMIE (FR) 1998-07-21 US disclosed