SCHEMBL9725

SCHEMBL9725

NCCC(N)=O.[KH]

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
SCHEMBL82768 0.96
Water SCHEMBL27884819 0.93
SCHEMBL821969 0.93
SCHEMBL821985 0.93
Hydrochloric Acid SCHEMBL793439 0.93
Ammonia Solution, Strong SCHEMBL13571350 0.93
SCHEMBL251118 0.93
Phosphine SCHEMBL31031792 0.93
SCHEMBL16447295 0.93
Hydrochloric Acid SCHEMBL9998745 0.93

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110275872-A1 PROCESS FOR THE SYNTHESIS OF ETHYNYLCYCLOPROPANE LONZA LTD (CH) 2011-11-10 US claimed
EP-2260014-B1 PROCESS FOR THE SYNTHESIS OF ETHYNYLCYCLOPROPANE LONZA AG (CH) 2011-09-28 EP claimed
EP-2260014-A1 PROCESS FOR THE SYNTHESIS OF ETHYNYLCYCLOPROPANE Lonza Ltd. (CH) 2010-12-15 EP claimed
WO-2009118179-A1 PROCESS FOR THE SYNTHESIS OF ETHYNYLCYCLOPROPANE LONZA LTD (CH) 2009-10-01 WO claimed
US-7183432-B2 Synthesis of ynamides IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2007-02-27 US claimed
US-20050272954-A1 Synthesis of ynamides IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2005-12-08 US claimed
US-11274177-B2 Terminally-functionalized cashew nut shell liquid derivatives INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2022-03-15 US disclosed
US-20200362087-A1 TERMINALLY-FUNCTIONALIZED CASHEW NUT SHELL LIQUID DERIVATIVES INTERNATIONAL BUSINESS MACHINES CORPORATION 2020-11-19 US disclosed
US-9233901-B2 Synthetic navel orangeworm pheromone composition and methods relating to production of same SUTERRA, LLC (US) 2016-01-12 US disclosed
EP-2913329-A1 METHOD FOR MANUFACTURING DIFLUORO ESTER COMPOUND Asahi Glass Company, Limited (JP) 2015-09-02 EP disclosed
US-20150197474-A1 SYNTHETIC NAVEL ORANGEWORM PHEROMONE COMPOSITION AND METHODS RELATING TO PRODUCTION OF SAME SUTERRA, LLC 2015-07-16 US disclosed
US-20150175632-A1 METHOD FOR PRODUCING DIFLUORO ESTER COMPOUND ASAHI GLASS COMPANY, LIMITED (JP) 2015-06-25 US disclosed
US-8940942-B2 Synthetic navel orangeworm pheromone composition and methods relating to production of same SUTERRA LLC (US) 2015-01-27 US disclosed
US-4863938-A Pyridine derivatives and their use as nootropic agents CIBA-GEIGY CORPORATION (US) 1989-09-05 US disclosed
US-4833169-A MEMORY ACTIVATORS CIBA-GEIGY CORPORATION (US) 1989-05-23 US disclosed
US-4804661-A ANALGESICS CIBA-GEIGY CORPORATION (US) 1989-02-14 US disclosed
US-4772630-A ANTIDEPRESSANTS, ANTISCHIZOPHRENIA CIBA-GEIGY CORP. (US) 1988-09-20 US disclosed
US-4614745-A Anti-allergic 3-(carboxycarbonyl)amino benzothiopyran-4-one derivatives, compositions, and method of use therefor CIBA-GEIGY CORPORATION (US) 1986-09-30 US disclosed
US-4559349-A TREATMENT OF PHYCHOSIS CIBA GEIGY CORPORATION (US) 1985-12-17 US disclosed
EP-0111105-A2 Unsaturated aromatic amides as pesticides THE WELLCOME FOUNDATION LIMITED (GB) 1984-06-20 EP disclosed