SCHEMBL8459222

SCHEMBL8459222

CC(=O)C(C)C(=O)C(C)(C)C

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
SCHEMBL1397144 0.84 CA1 (0.35)
SCHEMBL8736243 0.78
SCHEMBL8733316 0.78
SCHEMBL8733319 0.78
SCHEMBL19056892 0.77 TP53 (0.40)
SCHEMBL2467543 0.77 TP53 (0.40)
SCHEMBL2355707 0.74 TP53 (0.38)
SCHEMBL30394140 0.74 TP53 (0.38)
SCHEMBL14488048 0.74 CA2 (0.33)
SCHEMBL8462935 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10000509-B2 Broad spectrum beta-lactamase inhibitors GLADIUS PHARMACEUTICALS CORPORATION (CA) 2018-06-19 US disclosed
US-20180065989-A1 Broad Spectrum Beta-Lactamase Inhibitors GLADIUS PHARMACEUTICALS CORPORATION (CA) 2018-03-08 US disclosed
US-9862729-B2 Broad spectrum beta-lactamase inhibitors GLADIUS PHARMACEUTICALS CORPORATION (CA) 2018-01-09 US disclosed
US-20170327515-A1 Broad Spectrum Beta-Lactamase Inhibitors SOPHARMIA, INC. 2017-11-16 US disclosed
US-9809605-B1 Broad spectrum beta-lactamase inhibitors GLADIUS PHARMACEUTICALS CORPORATION (CA) 2017-11-07 US disclosed
US-20160362422-A1 BROAD SPECTRUM BETA-LACTAMASE INHIBITORS GLADIUS PHARMACEUTICALS CORPORATION (CA) 2016-12-15 US disclosed
US-9453032-B2 Broad spectrum beta-lactamase inhibitors GLADIUS PHARMACEUTICALS CORPORATION (CA) 2016-09-27 US disclosed
US-20150011524-A1 BROAD SPECTRUM BETA-LACTAMASE INHIBITORS SOPHARMIA, INC. 2015-01-08 US disclosed
US-7799776-B2 Indoleamine 2,3-dioxygenase (IDO) inhibitors THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2010-09-21 US disclosed
US-7799776-B2 Indoleamine 2,3-dioxygenase (IDO) inhibitors THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2010-09-21 US disclosed
US-20090042868-A1 Indoleamine 2,3-Dioxygenase (IDO) Inhibitors THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2009-02-12 US disclosed
US-20090042868-A1 Indoleamine 2,3-Dioxygenase (IDO) Inhibitors THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2009-02-12 US disclosed
EP-0646605-B1 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC (US) 1999-06-02 EP disclosed
US-5468704-A Comprising titanium halide or halogen alcoholate supported on magnesium halide and a diketone electron donor; preparing polypropylene of high isotacticity MONTELL NORTH AMERICA INC. (US) 1995-11-21 US disclosed
EP-0646605-A1 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC. (US) 1995-04-05 EP disclosed