SCHEMBL9977946

SCHEMBL9977946

C=[N+](CC)CC

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
Hydrochloric Acid SCHEMBL6952444 0.95
SCHEMBL14341635 0.76
SCHEMBL9634898 0.67
SCHEMBL16982021 0.67
SCHEMBL7691696 0.64
SCHEMBL98977 0.56
SCHEMBL352063 0.56
SCHEMBL1151227 0.53
SCHEMBL1363067 0.53
Propane SCHEMBL9488373 0.52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183170-A1 1,1-DISUBSTITUTED ETHYLENE PROCESS OPTMED, INC. 2023-06-15 US disclosed
US-20180029967-A1 GEM DIFLUOROCOMPOUNDS AS DEPIGMENTING OR LIGHTENING AGENTS TFCHEM (FR) 2018-02-01 US disclosed
WO-2016204570-A1 XANTHENE-BASED COMPOUND AND LIGHT-SENSITIVE RESIN COMPOSITION COMPRISING SAME 주식회사 엘지화학 2016-12-22 WO disclosed
US-20150166471-A1 1, 1-DISUBSTITUTED ETHYLENE PROCESS H.B. FULLER COMPANY 2015-06-18 US disclosed
US-20150166471-A1 1, 1-DISUBSTITUTED ETHYLENE PROCESS H.B. FULLER COMPANY 2015-06-18 US disclosed
US-20150158807-A1 METHYLIDENE MALONATE PROCESS H.B. FULLER COMPANY, AS COLLATERAL AGENT 2015-06-11 US disclosed
US-20150158807-A1 METHYLIDENE MALONATE PROCESS H.B. FULLER COMPANY, AS COLLATERAL AGENT 2015-06-11 US disclosed
US-8524892-B2 Methods and intermediates for the synthesis of porphyrins NORTH CAROLINA STATE UNIVERSITY (US) 2013-09-03 US disclosed
US-20130197263-A1 1,1-DISUBSTITUTED ETHYLENE PROCESS OPTMED, INC. (US) 2013-08-01 US disclosed
US-20130197264-A1 METHYLIDENE MALONATE PROCESS OPTMED, INC. (US) 2013-08-01 US disclosed
US-20120253052-A1 METHODS AND INTERMEDIATES FOR THE SYNTHESIS OF PORPHYRINS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-10-04 US disclosed
WO-2012080449-A1 AZABENZIMIDAZOLES AS RESPIRATORY SYNCYTIAL VIRUS ANTIVIRAL AGENTS JANSSEN R&D IRELAND (IE) 2012-06-21 WO disclosed
US-7951939-B2 Methods and intermediates for the synthesis of porphyrins NORTH CAROLINA STATE UNIVERSITY (US) 2011-05-31 US disclosed
WO-2010145037-A1 DISUBSTITUTED-AMINODIFLUOROSULFINIUM SALTS, PROCESS FOR PREPARING SAME AND METHOD OF USE AS DEOXOFLUORINATION REAGENTS OMEGACHEM INC. (CA) 2010-12-23 WO disclosed
US-20090198049-A1 METHODS AND INTERMEDIATES FOR THE SYNTHESIS OF PORPHYRINS NORTH CAROLINA STATE UNIVERSITY (US) 2009-08-06 US disclosed
US-7501508-B2 Methods and intermediates for the synthesis of porphyrins NORTH CAROLINE STATE UNIVERSITY (US) 2009-03-10 US disclosed
US-7439535-B2 Process for exchanging functional groups by halogen-metal exchange reaction BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-10-21 US disclosed
US-7196048-B2 Fabric care systems for providing anti-wrinkle benefits to fabric THE PROCTER & GAMBLE CO. (US) 2007-03-27 US disclosed
US-20070027311-A1 Methods and intermediates for the synthesis of porphyrins NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2007-02-01 US disclosed