SCHEMBL13041573

SCHEMBL13041573

CC1=NCC1

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
SCHEMBL7703054 0.70
SCHEMBL1617594 0.70
SCHEMBL8329831 0.66 NOS3 (0.48)
SCHEMBL16489783 0.66
SCHEMBL13368316 0.66 NOS3 (0.48)
SCHEMBL12422425 0.66 NOS3 (0.48)
SCHEMBL13368176 0.66 NOS3 (0.48)
SCHEMBL10296536 0.66
SCHEMBL14441515 0.66 NOS3 (0.48)
SCHEMBL10278309 0.66 NOS3 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9238667-B2 Rhodium catalyst and method for producing amine compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-19 US disclosed
US-9011734-B2 Ligand exchange thermochromic, (LETC), systems PLEOTINT, L.L.C. (US) 2015-04-21 US disclosed
US-20150051416-A1 RHODIUM CATALYST AND METHOD FOR PRODUCING AMINE COMPOUND SPERA PHARMA, INC. (JP) 2015-02-19 US disclosed
US-8716356-B2 Proton-conducting membrane and its use BASF FUEL CELL GMBH (DE) 2014-05-06 US disclosed
US-20130012607-A1 PROTON-CONDUCTING MEMBRANE AND ITS USE BASF FUEL CELL GMBH (DE) 2013-01-10 US disclosed
US-7838329-B2 precursor mixture comprising germanium bis(n-butyl, N,N-diisopropylamidinate, and solvent; chemical vapor depositing a germanium-antimony-tellurium (GST) films; microelectronic devices; infrared detectors ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2010-11-23 US disclosed
US-20100279011-A1 NOVEL BISMUTH PRECURSORS FOR CVD/ALD OF THIN FILMS ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2010-11-04 US disclosed
US-20100222352-A1 Compounds and Methods for the Treatment of Viruses and Cancer YALE UNIVERSITY (US) 2010-09-02 US disclosed
US-20090208637-A1 COBALT PRECURSORS USEFUL FOR FORMING COBALT-CONTAINING FILMS ON SUBSTRATES ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2009-08-20 US disclosed
US-20090087561-A1 METAL AND METALLOID SILYLAMIDES, KETIMATES, TETRAALKYLGUANIDINATES AND DIANIONIC GUANIDINATES USEFUL FOR CVD/ALD OF THIN FILMS ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2009-04-02 US disclosed