SCHEMBL977217

SCHEMBL977217

CC1(C)CNCCNCC(C)(C)SS1

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
SCHEMBL15928062 0.72 HIF1A (0.39)
SCHEMBL1442558 0.71
SCHEMBL2267693 0.69
SCHEMBL3990277 0.69 HIF1A (0.36)
Iodide SCHEMBL9065199 0.69
Hydrochloric Acid SCHEMBL31309953 0.67 HIF1A (0.33)
SCHEMBL3974293 0.67
SCHEMBL490935 0.65
SCHEMBL64209 0.65
SCHEMBL14801159 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6979431-B2 Method for labelling technetium or rhenium using borohydride exchange resin KOREA ATOMIC ENERGY RESEARCH INSTITUTE (KR) 2005-12-27 US claimed
US-20030194365-A1 Method for labelling technetium or rhenium using borohydride exchange resin KOREA ATOMIC ENERGY RESEARCH INSTITUTE (KR) 2003-10-16 US claimed
EP-1379499-B1 NEW DIAMINEDITHIOL DERIVATIVES AND RADIORHENIUM OR RADIOTECHNETIUM COMPLEX THEREOF; A LIVER CANCER-TREATING COMPOSITION COMPRISING THE RADIORHENIUM COMPLEX AND LIPIODOL; AND A KIT FOR PREPARATION OF THE LIVER CANCER-TREATING COMPOSITION SEOUL NAT UNIV IND FOUNDATION (KR) 2011-05-18 EP disclosed
US-7875287-B2 99mTc-8-[3-({2-[4-(2-methoxy-phenyl)-piperazine -1-yl]-ethyl}-pyridin-2-yl-amino)-propyl]-[1,2,5,8]dithiadiazecan-6-one; 5-HT1A selective serotonin receptors;receptivity; nonhydrolyzing; radiopharmaceuticals;scanning the brain; neurogenitive deseases; nervous system disorders KOREA ATOMIC ENERGY RESEARCH INSTITUTE (KR) 2011-01-25 US disclosed
EP-1379499-A4 NEW DIAMINEDITHIOL DERIVATIVES AND RADIORHENIUM OR RADIOTECHNETIUM COMPLEX THEREOF; A LIVER CANCER-TREATING COMPOSITION COMPRISING THE RADIORHENIUM COMPLEX AND LIPIODOL; AND A KIT FOR PREPARATION OF THE LIVER CANCER-TREATING COMPOSITION SEOUL NAT UNIV IND FOUNDATION (KR) 2009-08-05 EP disclosed
US-20070036715-A1 99mTc-8-[3-({2-[4-(2-methoxy-phenyl)-piperazine -1-yl]-ethyl}-pyridin-2-yl-amino)-propyl]-[1,2,5,8]dithiadiazecan-6-one; 5-HT1A selective serotonin receptors;receptivity; nonhydrolyzing; radiopharmaceuticals;scanning the brain; neurogenitive deseases; nervous system disorders KOREA ATOMIC ENERGY RESEARCH INSTITUTE (KR) 2007-02-15 US disclosed
US-7067508-B2 Diaminedithiol derivatives and radiorhenium or radiotechnetium complex thereof; a liver cancer-treating composition comprising the radiorhenium complex and lipiodol; and a kit for preparation of the liver cancer-treating composition SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2006-06-27 US disclosed
US-6979431-B2 Method for labelling technetium or rhenium using borohydride exchange resin KOREA ATOMIC ENERGY RESEARCH INSTITUTE (KR) 2005-12-27 US disclosed
US-6958141-B2 Rhenium and technetium complexes containing a hypoxia-localizing moiety BRACCO INTERNATIONAL B.V. (NL) 2005-10-25 US disclosed
US-6936240-B2 Method for the preparation of technetium or rhenium complex for radiopharmaceuticals KOREA ATOMIC ENERGY RESEARCH INSTITUTE (KR) 2005-08-30 US disclosed
US-6888019-B1 Method of preparing rhenium complex using borohydride exchange resin KOREA ATOMIC ENERGY RESEARCH INSTITUTE (KR) 2005-05-03 US disclosed
EP-0544412-B1 Rhenium and technetium complexes containing a hypoxia-localizing moiety BRACCO INT BV (NL) 1997-07-23 EP disclosed
US-5155227-A Compounds for site-enhanced delivery of radionuclides UNIVERSITY OF FLORIDA (US) 1992-10-13 US disclosed
US-5136038-A Radiopharmaceuticals and chelating agents useful in their preparation UNIVERSITY OF FLORIDA (US) 1992-08-04 US disclosed
US-4963688-A Compounds for site-enhanced delivery of radionuclides and uses thereof UNIVERSITY OF FLORIDA (US) 1990-10-16 US disclosed
US-4963682-A Novel radiopharmaceuticals and chelating agents useful in their preparation UNIVERSITY OF FLORIDA (US) 1990-10-16 US disclosed
EP-0191788-A1 NOVEL RADIOPHARMACEUTICALS AND CHELATING AGENTS USEFUL IN THEIR PREPARATION UNIVERSITY OF FLORIDA (US) 1986-08-27 EP disclosed
EP-0187832-A1 COMPOUNDS FOR SITE-ENHANCED DELIVERY OF RADIONUCLIDES AND USES THEREOF UNIVERSITY OF FLORIDA (US) 1986-07-23 EP disclosed
WO-1986000897-A1 NOVEL RADIOPHARMACEUTICALS AND CHELATING AGENTS USEFUL IN THEIR PREPARATION UNIVERSITY OF FLORIDA (US) 1986-02-13 WO disclosed
WO-1986000898-A1 COMPOUNDS FOR SITE-ENHANCED DELIVERY OF RADIONUCLIDES AND USES THEREOF UNIVERSITY OF FLORIDA (US) 1986-02-13 WO disclosed