SCHEMBL2967984

SCHEMBL2967984

C=CCC(C)(C)C(=O)Br

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
SCHEMBL4453702 0.79 CCR2 (0.36)
SCHEMBL6729397 0.77
SCHEMBL9801312 0.77
SCHEMBL28768776 0.77
SCHEMBL293485 0.77
SCHEMBL2743655 0.76 CCR2 (0.33)
SCHEMBL623307 0.75
SCHEMBL1114546 0.75
SCHEMBL6717591 0.75
SCHEMBL4178687 0.75

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
WO-2012142670-A1 NUCLEAR MAGNETIC RESONANCE AGENT THE UNIVERSITY OF QUEENSLAND (AU) 2012-10-26 WO disclosed
US-8278400-B2 Antifouling materials containing cationic polysiloxanes NDSU RESEARCH FOUNDATION (US) 2012-10-02 US disclosed
US-20100204399-A1 ANTIFOULING MATERIALS CONTAINING CATIONIC POLYSILOXANES NDSU RESEARCH FOUNDATION 2010-08-12 US disclosed
US-7771833-B2 Anti-fouling materials containing cationic polysiloxanes NDSU RESEARCH FOUNDATION (US) 2010-08-10 US disclosed
US-7544722-B2 aquatic environment; block polymers having a carbon and/or silicone backbone with a pendant biocidal/fouling release group; dimethylsiloxane-vinylmethyl siloxane-Triclosan methacrylate ester block polymer; isoprene-triclosan methacrylate-methacrylic acid with pendant polydimethylsiloxane at the carboxy NDSU RESEARCH FOUNDATION (US) 2009-06-09 US disclosed
EP-1879972-A4 ANTI-FOULING MATERIALS CONTAINING POLYAMINE CROSS-LINKED POLYSILOXANES NDSU RES FOUNDATION (US) 2008-10-15 EP disclosed
EP-1879972-A1 ANTI-FOULING MATERIALS CONTAINING POLYAMINE CROSS-LINKED POLYSILOXANES NDSU Research Foundation (US) 2008-01-23 EP disclosed
EP-1663531-A4 ANTI-FOULING MATERIALS NDSU RES FOUNDATION (US) 2007-11-28 EP disclosed
US-20070042199-A1 Anti-fouling materials containing cationic polysiloxanes NDSU RESEARCH FOUNDATION 2007-02-22 US disclosed
US-20070021529-A1 POLYMERIC MATERIALS WITH ANTI-FOULING ACTIVITY NDSU RESEARCH FOUNDATION 2007-01-25 US disclosed
WO-2006121937-A1 ANTI-FOULING MATERIALS CONTAINING POLYAMINE CROSS-LINKED POLYSILOXANES NDSU RESEARCH FOUNDATION (US) 2006-11-16 WO disclosed
EP-1663531-A2 ANTI-FOULING MATERIALS NDSU Research Foundation (US) 2006-06-07 EP disclosed
WO-2005030405-A2 ANTI-FOULING MATERIALS NDSU RESEARCH FOUNDATION (US) 2005-04-07 WO disclosed