SCHEMBL548844

SCHEMBL548844

C=CCC(C)C=O

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
SCHEMBL17542246 1.00
SCHEMBL548843 1.00
SCHEMBL13978920 0.76
SCHEMBL8322115 0.76
SCHEMBL2153981 0.75
SCHEMBL2614303 0.75 TP53 (0.32)
SCHEMBL675611 0.75
SCHEMBL790603 0.75
SCHEMBL4584154 0.75 TP53 (0.32)
SCHEMBL12808547 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108929267-B Quinolone skeleton and synthesis method thereof 中南大学 2021-07-02 CN claimed
EP-3455200-A1 PROCESS FOR PRODUCTION OF MIXED 2,2-DIALKYL-1,3-PROPANEDIOLS Perstorp AB (SE) 2019-03-20 EP claimed
WO-2017196225-A1 PROCESS FOR PRODUCTION OF MIXED 2,2-DIALKYL-1,3-PROPANEDIOLS PERSTORP AB (SE) 2017-11-16 WO claimed
WO-2016042172-A1 IMIDAZO[2,1-B]THIAZOLE AND 5,6-DIHYDROIMIDAZO[2,1-B]THIAZOLE DERIVATIVES USEFUL AS S100-INHIBITORS ACTIVE BIOTECH AB (SE) 2016-03-24 WO claimed
CN-103664591-A Novel benzendiol derivative compound and cosmetic composition utilizing the same ACT CO LTD 2014-03-26 CN claimed
US-8486892-B2 Blood coagulation factor inhibitors NOVO NORDISK HEALTH CARE AG (CH) 2013-07-16 US claimed
EP-1799729-B1 FUNCTIONAL SILOXANES AND THEIR VINYL CO-POLYMERS HONEYWELL INT INC (US) 2012-10-17 EP claimed
CN-101981050-A New blood coagulation factor inhibitors NOVO NORDISK HEALTHCARE AG 2011-02-23 CN claimed
US-20110003752-A1 New Blood Coagulation Factor Inhibitors NOVO NORDISK HEALTH CARE A/G (CH) 2011-01-06 US claimed
EP-2235042-A1 NEW BLOOD COAGULATION FACTOR INHIBITORS Novo Nordisk Health Care AG (CH) 2010-10-06 EP claimed
WO-2009092758-A1 NEW BLOOD COAGULATION FACTOR INHIBITORS NOVO NORDISK HEALTH CARE AG (DK) 2009-07-30 WO claimed
CN-101010355-A Functionalized siloxanes and silanes and their vinyl copolymers HONEYWELL INT INC (US) 2007-08-01 CN claimed
EP-1799729-A1 FUNCTIONAL SILOXANES AND SILANES AND THEIR VINYL CO-POLYMERS Honeywell International, Inc. (US) 2007-06-27 EP claimed
WO-2006014328-A1 FUNCTIONAL SILOXANES AND SILANES AND THEIR VINYL CO-POLYMERS HONEYWELL INTERNATIONAL INC. (US) 2006-02-09 WO claimed
EP-1098699-B1 PRODUCTION OF GLYCOL MONOESTER EASTMAN CHEM CO (US) 2003-05-14 EP claimed
JP-2002519274-A 2002-07-02 JP claimed
EP-1098699-A1 BASIC CLAY CATALYST FOR THE PRODUCTION OF GLYCOL MONOESTER EASTMAN CHEMICAL COMPANY (US) 2001-05-16 EP claimed
US-6215020-B1 COMPRISING HEATING IN A REACTION VESSEL AN ALDEHYDE AND A CATALYTIC AMOUNT OF A BASE-MODIFIED CLAY, TO PRODUCE A GLYCOL MONOESTER EASTMAN CHEMICAL COMPANY 2001-04-10 US claimed
WO-2000000282-A1 BASIC CLAY CATALYST FOR THE PRODUCTION OF GLYCOL MONOESTER EASTMAN CHEMICAL COMPANY (US) 2000-01-06 WO claimed
WO-2000000456-A1 PREPARATION OF AN ALDOL USING A BASE-MODIFIED CLAY CATALYST EASTMAN CHEMICAL COMPANY (US) 2000-01-06 WO claimed