SCHEMBL61121

SCHEMBL61121

[C]1CCCC2CC3CCCC=C3C=C12

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
SCHEMBL37555 0.75
SCHEMBL5499429 0.72
SCHEMBL486038 0.69 KDM1A (0.37)
SCHEMBL1617400 0.63 KDM1A (0.31)
SCHEMBL1123791 0.62
SCHEMBL168474 0.62
SCHEMBL11316508 0.60 NOS1 (0.32)
SCHEMBL8888043 0.58
SCHEMBL61776 0.58 KDM4E (0.37)
SCHEMBL3813203 0.57

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 583 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9045569-B2 Process of making modified metallocene catalyst, catalyst produced and use thereof W. R. GRACE & CO.-CONN. (US) 2015-06-02 US claimed
EP-1392741-B1 PROCESS FOR PREPARING SUPPORTED TRANSITION METAL CATALYST SYSTEMS AND CATALYST SYSTEMS PREPARED THEREBY GRACE W R & CO (US) 2014-06-25 EP claimed
EP-2663400-A1 PROCESS OF MAKING MODIFIED METALLOCENE CATALYST, CATALYST PRODUCED AND USE THEREOF W. R. Grace & Co.-Conn (US) 2013-11-20 EP claimed
US-20130289227-A1 PROCESS OF MAKING MODIFIED METALLOCENE CATALYST, CATALYST PRODUCED AND USE THEREOF W.R. GRACE & CO.-CONN (US) 2013-10-31 US claimed
EP-1242478-B1 METALLOCENE AND CONSTRAINED GEOMETRY CATALYST SYSTEMS EMPLOYING AGGLOMERATED METAL OXIDE/CLAY SUPPORT-ACTIVATOR AND METHOD OF THEIR PREPARATION GRACE W R & CO (US) 2012-12-05 EP claimed
WO-2012097146-A1 PROCESS OF MAKING MODIFIED METALLOCENE CATALYST, CATALYST PRODUCED AND USE THEREOF W. R. GRACE & CO.-CONN. (US) 2012-07-19 WO claimed
US-7491672-B2 Chemically-modified supports and supported catalyst systems prepared therefrom INEOS EUROPE LIMITED (GB) 2009-02-17 US claimed
US-20070105709-A1 Chemically-modified supports and supported catalyst systems prepared therefrom INEOS COMMERCIAL SERVICES UK LIMITED (GB) 2007-05-10 US claimed
EP-1399491-B1 SUPPORTED DUAL TRANSITION METAL CATALYST SYSTEMS GRACE W R & CO (US) 2006-08-23 EP claimed
US-6943224-B2 Process for preparing supported transition metal catalyst systems and catalyst systems prepared thereby W. R. GRACE & CO.-CONN. (US) 2005-09-13 US claimed
EP-1242478-A1 METALLOCENE AND CONSTRAINED GEOMETRY CATALYST SYSTEMS EMPLOYING AGGLOMERATED METAL OXIDE/CLAY SUPPORT-ACTIVATOR AND METHOD OF THEIR PREPARATION W. R. Grace &amp; Co.-Conn (US) 2002-09-25 EP claimed
EP-1196424-A1 DIMERIC GROUP 4 METALLOCENES IN +3 OXIDATION STATE THE DOW CHEMICAL COMPANY (US) 2002-04-17 EP claimed
WO-2002026842-A1 SUPPORTED CATALYST SYSTEMS BP CHEMICALS LIMITED (GB) 2002-04-04 WO claimed
WO-2001058969-A1 CHEMICALLY-MODIFIED SUPPORTS AND SUPPORTED CATALYST SYSTEMS PREPARED THEREFROM BP CHEMICALS LIMITED (GB) 2001-08-16 WO claimed
WO-2001032721-A1 METALLOCENE AND CONSTRAINED GEOMETRY CATALYST SYSTEMS EMPLOYING AGGLOMERATED METAL OXIDE/CLAY SUPPORT-ACTIVATOR AND METHOD OF THEIR PREPARATION W. R. GRACE & CO.-CONN. (US) 2001-05-10 WO claimed
WO-2000075152-A1 DIMERIC GROUP 4 METALLOCENES IN +3 OXIDATION STATE THE DOW CHEMICAL COMPANY (US) 2000-12-14 WO claimed
EP-0977808-A1 AMORPHOUS PROPYLENE-POLYENE COPOLYMERS AND COMPOSITIONS THEREOF THE DOW CHEMICAL COMPANY (US) 2000-02-09 EP claimed
WO-1998049229-A1 AMORPHOUS PROPYLENE-POLYENE COPOLYMERS AND COMPOSITIONS THEREOF THE DOW CHEMICAL COMPANY (US) 1998-11-05 WO claimed
EP-0781299-B1 SILYLIUM CATIONIC POLYMERIZATION ACTIVATORS FOR METALLOCENE COMPLEXES DOW CHEMICAL CO (US) 1998-09-09 EP claimed
US-5721183-A ADDITION POLYMERIZATION CATALYSTS; INCLUDING GROUP 4 METAL COMPLEX THE DOW CHEMICAL COMPANY (US) 1998-02-24 US claimed