SCHEMBL2076629

SCHEMBL2076629

CCOCC(C#N)C#N

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
SCHEMBL4848241 0.82 — —
SCHEMBL3214992 0.76 — —
SCHEMBL11042293 0.74 — —
SCHEMBL4398819 0.74 — —
SCHEMBL28083347 0.72 HSD17B10 (0.31) —
SCHEMBL11022170 0.72 — —
SCHEMBL2857837 0.72 THRB (0.33) —
SCHEMBL15840125 0.71 — —
SCHEMBL1571222 0.70 — —
SCHEMBL21045048 0.70 TSHR (0.45) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240213499-A1 PRIMARY ALKALI METAL CELLS WITH GEMINAL DINITRILE ADDITIVES LITRONIK BATTERIETECHNOLOGIE GMBH (DE) 2024-06-27 — — US disclosed
WO-2022257875-A1 PYRIMIDINE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海日馨医药科技股份有限公司 2022-12-15 — — WO disclosed
EP-2024360-B1 SUBSTITUTED PYRAZOLOPYRIMIDINES CEPHALON INC (US) 2013-04-03 — — EP disclosed
US-8354414-B2 Substituted bicyclic pyrimidines CEPHALON, INC (US) 2013-01-15 — — US disclosed
EP-2351751-A1 Substituted pyrazolopyrimidines CEPHALON, INC. (US) 2011-08-03 — — EP disclosed
US-20110053920-A1 SUBSTITUTED BICYCLIC PYRIMIDINES CEPHALON, INC. (US) 2011-03-03 — — US disclosed
US-7851468-B2 Substituted pyrazolo[3,4-d]pyrimidines CEPHALON, INC. (US) 2010-12-14 — — US disclosed
US-20090247751-A1 PROCESS FOR THE PREPARATION OF ZALEPLON AND AN INTERMEDIATE THEREOF PIRAMAL HEALTHCARE LIMITED (IN) 2009-10-01 — — US disclosed
EP-2024360-A2 SUBSTITUTED PYRAZOLOPYRIMIDINES Cephalon, Inc. (US) 2009-02-18 — — EP disclosed
WO-2008063232-A2 SUBSTITUTED PYRAZOLOPYRIMIDINES CEPHALON, INC. (US) 2008-05-29 — — WO disclosed
US-20070281949-A1 Substituted pyrazolopyrimidines CEPHALON, INC. (US) 2007-12-06 — — US disclosed
EP-1583606-A1 PROCESS FOR PRODUCTION OF HIGH OCTANE GASOLINE FROM STRAIGHT RUN LIGHT NAPHTHA ON Pt CONTAINING HZSM - 5 MOLECULAR SIEVE CATALYST Council of Scientific and Industrial Research (IN) 2005-10-12 — — EP disclosed
US-20040182748-A1 Process for production of high octane gasoline from straight run light naphtha on Pt containing HZSM - 5 molecular sieve catalyst COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH 2004-09-23 — — US disclosed
WO-2004058400-A1 PROCESS FOR PRODUCTION OF HIGH OCTANE GASOLINE FROM STRAIGHT RUN LIGHT NAPHTHA ON Pt CONTAINING HZSM - 5 MOLECULAR SIEVE CATALYST COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2004-07-15 — — WO disclosed
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