SCHEMBL988006

SCHEMBL988006

Cn1cc[n+](C[n+]2ccn(C)c2)c1

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
Iodide SCHEMBL4384951 0.97 ALDH1A1 (0.31)
Bromide SCHEMBL4380424 0.97 ALDH1A1 (0.31)
SCHEMBL173392 0.84
SCHEMBL6114516 0.83
Fluoride Ion SCHEMBL4200938 0.82 ALDH1A1 (0.30)
Iodide SCHEMBL380492 0.82 ALDH1A1 (0.33)
Bromide SCHEMBL21777064 0.82 ALDH1A1 (0.33)
Bromide SCHEMBL21777066 0.82 ALDH1A1 (0.30)
Bromide SCHEMBL2214550 0.82 ALDH1A1 (0.33)
Ammonia Solution, Strong SCHEMBL28942112 0.82 ALDH1A1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180079651-A1 NOVEL METHODS FOR PRODUCING CRYSTALLINE MICROPOROUS SOLIDS WITH THE RTH TOPOLOGY AND COMPOSITIONS DERIVED FROM THE SAME CALIFORNIA INSTITUTE OF TECHNOLOGY 2018-03-22 US disclosed
US-9908783-B2 Methods for producing crystalline microporous solids with the RTH topology and compositions derived from the same CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2018-03-06 US disclosed
US-9873113-B2 Methods for producing crystalline microporous solids with a new CIT-7 topology and compositions derived from the same CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2018-01-23 US disclosed
US-9861968-B2 Methods for producing crystalline microporous solids with the HEU topology and compositions derived from the same CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2018-01-09 US disclosed
EP-2474527-B1 IONIC LIQUID CONTAINING ALLYLSULFONATE ANION WAKO PURE CHEM IND LTD (JP) 2017-01-25 EP disclosed
EP-2718394-B1 PHOSPHORESCENT METAL COMPLEX COMPOUND, METHOD FOR THE PRODUCTION THEREOF AND RADIATION EMITTING STRUCTURAL ELEMENT OSRAM GMBH (DE) 2015-08-26 EP disclosed
US-20150202612-A1 NOVEL METHODS FOR PRODUCING CRYSTALLINE MICROPOROUS SOLIDS WITH THE RTH TOPOLOGY AND COMPOSITIONS DERIVED FROM THE SAME CALIFORNIA INSTITUTE OF TECHNOLOGY 2015-07-23 US disclosed
US-20150202603-A1 NOVEL METHODS FOR PRODUCING CRYSTALLINE MICROPOROUS SOLIDS WITH THE HEU TOPOLOGY AND COMPOSITIONS DERIVED FROM THE SAME NATIONAL SCIENCE FOUNDATION 2015-07-23 US disclosed
US-20150203357-A1 NOVEL METHODS FOR PRODUCING CRYSTALLINE MICROPOROUS SOLIDS WITH A NEW CIT-7 TOPOLOGY AND COMPOSITIONS DERIVED FROM THE SAME CALIFORNIA INSTITUTE OF TECHNOLOGY 2015-07-23 US disclosed
US-8940904-B2 Use of transition metal-carbene complexes which do not comprise any cyclometallation via non-carbenes in OLEDs BASF SE (DE) 2015-01-27 US disclosed
EP-2463266-A1 PROCESS FOR PRODUCTION OF BIS-QUATERNARY AMMONIUM SALT, AND NOVEL INTERMEDIATE Wako Pure Chemical Industries, Ltd. (JP) 2012-06-13 EP disclosed
US-20120130107-A1 PROCESS FOR PRODUCTION OF BIS-QUATERNARY AMMONIUM SALT, AND NOVEL INTERMEDIATE WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2012-05-24 US disclosed
US-20120130107-A1 PROCESS FOR PRODUCTION OF BIS-QUATERNARY AMMONIUM SALT, AND NOVEL INTERMEDIATE WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2012-05-24 US disclosed
WO-2011000616-A1 PHOSPHORESCENT METAL COMPLEX COMPOUND, METHOD FOR THE PRODUCTION THEREOF AND RADIATION EMITTING STRUCTURAL ELEMENT SIEMENS AKTIENGESELLSCHAFT (DE) 2011-01-06 WO disclosed
US-20090326237-A1 USE OF PT-AND PD-BIS-AND TETRA-CARBON COMPLEXES WITH BRIDGED CARBON LIGANDS IN OLEDS BASF SE (DE) 2009-12-31 US disclosed
US-20090326237-A1 USE OF PT-AND PD-BIS-AND TETRA-CARBON COMPLEXES WITH BRIDGED CARBON LIGANDS IN OLEDS BASF SE (DE) 2009-12-31 US disclosed
US-20090326237-A1 USE OF PT-AND PD-BIS-AND TETRA-CARBON COMPLEXES WITH BRIDGED CARBON LIGANDS IN OLEDS BASF SE (DE) 2009-12-31 US disclosed
EP-2044169-B1 USE OF PT- AND PD-BIS- AND TETRA-CARBON COMPLEXES WITH BRIDGED CARBON LIGANDS IN OLEDS BASF SE (DE) 2009-11-25 EP disclosed
WO-2008000727-A1 USE IN OLEDS OF TRANSITION METAL CARBENE COMPLEXES THAT CONTAIN NO CYCLOMETALLATION VIA NON-CARBENES BASF SE (DE) 2008-01-03 WO disclosed
WO-2008000726-A1 USE OF PT- AND PD-BIS- AND TETRA-CARBON COMPLEXES WITH BRIDGED CARBON LIGANDS IN OLEDS BASF SE (DE) 2008-01-03 WO disclosed