SCHEMBL2465780

SCHEMBL2465780

CCC(CC)CC=NO

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
SCHEMBL13678300 0.76
SCHEMBL265303 0.76
SCHEMBL12309935 0.76
SCHEMBL18602348 0.74
SCHEMBL10027830 0.72 CACNA2D1 (0.44)
SCHEMBL12251291 0.72
SCHEMBL10595937 0.71
SCHEMBL264513 0.71
SCHEMBL2762351 0.71
SCHEMBL11115125 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9200113-B2 Multi-amine functional oligomers and method for producing the same by the reduction of corresponding oximes COVESTRO DEUTSCHLAND AG (DE) 2015-12-01 US disclosed
EP-1040094-B9 SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS BIOCRYST PHARM INC (US) 2015-09-09 EP disclosed
US-20130066112-A1 MULTI-AMINE FUNCTIONAL OLIGOMERS AND METHOD FOR PRODUCING THE SAME BY THE REDUCTION OF CORRESPONDING OXIMES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-03-14 US disclosed
EP-2545101-A2 MULTI-AMINE FUNCTIONAL OLIGOMERS AND METHOD FOR PRODUCING THE SAME BY THE REDUCTION OF CORRESPONDING OXIMES Bayer Intellectual Property GmbH (DE) 2013-01-16 EP disclosed
WO-2011110535-A2 MULTI-AMINE FUNCTIONAL OLIGOMERS AND METHOD FOR PRODUCING THE SAME BY THE REDUCTION OF CORRESPONDING OXIMES BAYER MATERIALSCIENCE AG (DE) 2011-09-15 WO disclosed
EP-1040094-B1 SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS BIOCRYST PHARM INC (US) 2009-03-18 EP disclosed
US-7038059-B2 Process for preparation of 4-n-substituted amino-2-aza-1-oxabicyclo[3.3.0] oct-2-ene-6-carboxylic acid esters and process for preparation of their intermediates KURARAY CO., LTD. (JP) 2006-05-02 US disclosed
EP-1040094-A4 SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS BIOCRYST PHARM INC (US) 2004-12-08 EP disclosed
US-20040121482-A1 Process for preparation of 4-n-substituted amino-2-aza-1-oxabicyclo[3.3.0] oct-2-ene-6-carboxylic acid esters and process for preparation of their intermediates KURARAY CO., LTD. (JP) 2004-06-24 US disclosed
EP-1334969-A1 PROCESS FOR PREPARATION OF 4-N-SUBSTITUTED AMINO-2-AZA-1-OXABICYCLO 3.3.0]OCT-2-ENE-6-CARBOXYLIC ACID ESTERS AND PROCESS FOR PREPARATION OF THEIR INTERMEDIATES KURARAY CO., LTD. (JP) 2003-08-13 EP disclosed
US-6562861-B1 (1R,3R,4R,1'S)-(-)-(1'-acetylamino-2 '-ethyl)butyl-4-(aminoimino)methylaminocyclopentan-1-carboxylic acid was prepd. and tested in vitro as neuraminidase inhibitor (IC50 less-than 1.mu.M). Bactericides or viricides BIOCRYST PHARMACEUTICALS, INC. 2003-05-13 US disclosed
EP-1040094-A1 SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS BIOCRYST PHARMACEUTICALS INC. (US) 2000-10-04 EP disclosed
WO-1999033781-A1 SUBSTITUTED CYCLOPENTANE AND CYCLOPENTENE COMPOUNDS USEFUL AS NEURAMINIDASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 1999-07-08 WO disclosed