SCHEMBL985887

SCHEMBL985887

PC1(C2CCCCC2)C2CC3CC(C2)CC1(C1CCCCC1)C3

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
SCHEMBL11678107 0.73 SIGMAR1 (0.33)
SCHEMBL27762634 0.72
SCHEMBL5735985 0.72
SCHEMBL5734363 0.72
SCHEMBL5737366 0.72
SCHEMBL5737498 0.72
SCHEMBL27762632 0.72
SCHEMBL11677852 0.71 ALDH1A1 (0.30)
SCHEMBL294644 0.66 EPHX1 (0.35)
SCHEMBL15922703 0.66 EPHX1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101031595-A One-component cationic palladium pre-initiator for the latent polymerization of cycloolefins PROMERUS LLC (US) 2007-09-05 CN claimed
EP-1680218-A2 SINGLE COMPONENT CATIONIC PALLADIUM PROINITIATORS FOR THE LATENT POLYMERIZATION OF CYCLOOLEFINS Promerus, LLC (US) 2006-07-19 EP claimed
WO-2005042147-A2 SINGLE COMPONENT CATIONIC PALLADIUM PROINITIATORS FOR THE LATENT POLYMERIZATION OF CYCLOOLEFINS PROMERUS, LLC (US) 2005-05-12 WO claimed
US-20110009578-A1 Use Of A Combination Chain Transfer And Activating Agent To Control Molecular Weight And Optical Density Of Pd Catalyzed Norbornene Polymers PROMERUS LLC (US) 2011-01-13 US disclosed
US-7759439-B2 Use of a combination chain transfer and activating agent to control molecular weight and optical density of Pd catalyzed norbornene polymers PROMERUS LLC (US) 2010-07-20 US disclosed
EP-2134754-A1 USE OF A COMBINATION CHAIN TRANSFER AND ACTIVATING AGENT TO CONTROL MOLECULAR WEIGHT AND OPTICAL DENSITY OF PD CATALYZED NORBORNENE POLYMERS Promerus LLC (US) 2009-12-23 EP disclosed
WO-2008121804-A1 USE OF A COMBINATION CHAIN TRANSFER AND ACTIVATING AGENT TO CONTROL MOLECULAR WEIGHT AND OPTICAL DENSITY OF PD CATALYZED NORBORNENE POLYMERS PROMERUS LLC (US) 2008-10-09 WO disclosed
US-20080242810-A1 Use of a Combination Chain Transfer and Activating Agent to Control Molecular Weight and Optical Density of Pd Catalyzed Norbornene Polymers PROMERUS LLC (US) 2008-10-02 US disclosed
CN-101031595-A One-component cationic palladium pre-initiator for the latent polymerization of cycloolefins PROMERUS LLC (US) 2007-09-05 CN disclosed
EP-1680218-A2 SINGLE COMPONENT CATIONIC PALLADIUM PROINITIATORS FOR THE LATENT POLYMERIZATION OF CYCLOOLEFINS Promerus, LLC (US) 2006-07-19 EP disclosed
US-20050187398-A1 Single component cationic palladium proinitiators for the latent polymerization of cycloolefins PROMERUS, LLC 2005-08-25 US disclosed
WO-2005042147-A2 SINGLE COMPONENT CATIONIC PALLADIUM PROINITIATORS FOR THE LATENT POLYMERIZATION OF CYCLOOLEFINS PROMERUS, LLC (US) 2005-05-12 WO disclosed