Cyanate

Cyanate

SCHEMBL665073

CCCC[n+]1ccn(C)c1C.CCCC[n+]1ccn(C)c1C.N#C[O-].N#C[O-]

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.44
CA2 P00918 5/20 0.44
EEF2K O00418 2/20 0.35
EEF2 P13639 2/20 0.35
MEN1 O00255 1/20 0.35
PLK4 O00444 1/20 0.35
JAK2 O60674 1/20 0.35
EGFR P00533 1/20 0.35
TYK2 P29597 1/20 0.35
FLT3 P36888 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.35
ITK Q08881 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
HDAC8 Q9BY41 1/20 0.33
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HTT P42858 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Cyanamide SCHEMBL2009649 0.90 CA1 (0.44) CA1CA2EEF2KEEF2MEN1
Thiocyanic Acid SCHEMBL5307355 0.90 CA1 (0.44) CA1CA2EEF2KEEF2MEN1
SCHEMBL28239043 0.89 CA1 (0.51) CA1CA2EEF2KEEF2MEN1
SCHEMBL294424 0.89 CA1 (0.51) CA1CA2EEF2KEEF2MEN1
SCHEMBL666574 0.89 CA1 (0.41) CA1CA2EEF2KEEF2MEN1
SCHEMBL5797604 0.88 CA1 (0.47) CA1CA2EEF2KEEF2MEN1
Iodide SCHEMBL596676 0.88 CA1 (0.50) CA1CA2EEF2KEEF2MEN1
Bromide SCHEMBL711968 0.88 CA1 (0.54) CA1CA2EEF2KEEF2MEN1
Water SCHEMBL7031556 0.88 CA1 (0.50) CA1CA2EEF2KEEF2MEN1
Hydrochloric Acid SCHEMBL192472 0.88 CA1 (0.50) CA1CA2EEF2KEEF2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170204241-A1 ELECTRICALLY CONDUCTIVE POLYMER COMPLEXES AND ELECTRONIC DEVICES CONTAINING SUCH COMPLEXES RHODIA OPERATIONS (FR) 2017-07-20 US disclosed
EP-3167005-A1 ELECTRICALLY CONDUCTIVE POLYMER COMPLEXES AND ELECTRONIC DEVICES CONTAINING SUCH COMPLEXES Rhodia Operations (FR) 2017-05-17 EP disclosed
US-9552903-B2 Polymer compositions, polymer films, polymer gels, polymer foams, and electronic devices containing such films, gels and foams RHODIA OPERATIONS (FR) 2017-01-24 US disclosed
US-20160312006-A1 POLYMER COMPOSITIONS, FILMS, GELS, AND FOAMS CONTAINING SULFONYLIMIDE SALTS, AND ELECTRONIC DEVICES CONTAINING SUCH FILMS, GELS, AND FOAMS RHODIA OPERATIONS (FR) 2016-10-27 US disclosed
US-9378859-B2 Polymer compositions, polymer films, polymer gels, polymer foams, and electronic devices containing such films, gels and foams RHODIA OPERATIONS (FR) 2016-06-28 US disclosed
WO-2016090087-A1 ELECTRICALLY CONDUCTIVE POLYMER FILMS AND COMPLEXES CONTAINING A CONDUCTIVITY ENHANCING AGENT, AND ELECTRONIC DEVICES CONTAINING SUCH FILMS AND COMPLEXES RHODIA OPERATIONS (FR) 2016-06-09 WO disclosed
WO-2016007746-A1 ELECTRICALLY CONDUCTIVE POLYMER COMPLEXES AND ELECTRONIC DEVICES CONTAINING SUCH COMPLEXES RHODIA OPERATIONS (FR) 2016-01-14 WO disclosed
WO-2015089001-A1 POLYMER FILMS, GELS, AND FOAMS CONTAINING ELECTRICALLY CONDUCTIVE PATTERNS, AND ELECTRONIC DEVICES CONTAINING SUCH FILMS, GELS, AND FOAMS RHODIA OPERATIONS (FR) 2015-06-18 WO disclosed
WO-2015088999-A1 POLYMER COMPOSITIONS, FILMS, GELS, AND FOAMS CONTAINING SULFONYLIMIDE SALTS, AND ELECTRONIC DEVICES CONTAINING SUCH FILMS, GELS, AND FOAMS RHODIA OPERATIONS (FR) 2015-06-18 WO disclosed
US-20140291584-A1 POLYMER COMPOSITIONS, POLYMER FILMS, POLYMER GELS, POLYMER FOAMS, AND ELECTRONIC DEVICES CONTAINING SUCH FILMS, GELS AND FOAMS RHODIA OPERATIONS (FR) 2014-10-02 US disclosed
US-8784690-B2 Polymer compositions, polymer films, polymer gels, polymer foams, and electronic devices containing such films, gels and foams RHODIA OPERATIONS (FR) 2014-07-22 US disclosed
EP-2606530-A2 POLYMER COMPOSITIONS, POLYMER FILMS, POLYMER GELS, POLYMER FOAMS, AND ELECTRONIC DEVICES CONTAINING SUCH FILMS, GELS, AND FOAMS Rhodia Operations (FR) 2013-06-26 EP disclosed
EP-2606491-A1 FILMS CONTAINING ELECTRICALLY CONDUCTIVE POLYMERS Rhodia Operations (FR) 2013-06-26 EP disclosed
US-20120052395-A1 Polymer compositions, polymer films, polymer gels, polymer foams, and electronic devices containing such films, gels and foams CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-03-01 US disclosed
WO-2012023989-A2 POLYMER COMPOSITIONS, POLYMER FILMS, POLYMER GELS, POLYMER FOAMS, AND ELECTRONIC DEVICES CONTAINING SUCH FILMS, GELS, AND FOAMS RHODIA OPERATIONS (FR) 2012-02-23 WO disclosed
WO-2012023992-A1 FILMS CONTAINING ELECTRICALLY CONDUCTIVE POLYMERS RHODIA OPERATIONS (FR) 2012-02-23 WO disclosed
US-20120043530-A1 Polymer compositions, polymer films, polymer gels, polymer foams, and electronic devices containing such films, gels and foams CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-02-23 US disclosed