SCHEMBL308202

SCHEMBL308202

[C]#CC

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
SCHEMBL2901 1.00
SCHEMBL10491054 0.93
SCHEMBL9125481 0.93
SCHEMBL25229103 0.78
SCHEMBL5327872 0.74
SCHEMBL16861379 0.67
SCHEMBL4835 0.61
SCHEMBL846631 0.58
SCHEMBL18042130 0.58
SCHEMBL18681 0.55

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140243340-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBVIE INC. (US) 2014-08-28 US disclosed
US-20130131085-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2013-05-23 US disclosed
US-20120309762-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2012-12-06 US disclosed
EP-2465856-A2 Cytochrome P450 oxidase inhibitors and uses thereof Abbott Laboratories (US) 2012-06-20 EP disclosed
EP-2465855-A1 Cytochrome P450 oxidase inhibitors and uses thereof Abbott Laboratories (US) 2012-06-20 EP disclosed
US-20120083490-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2012-04-05 US disclosed
US-8093354-B2 Process for preparing glycopeptide phosphonate derivatives THERAVANCE, INC. (US) 2012-01-10 US disclosed
US-20110060122-A1 PROCESS FOR PREPARING GLYCOPEPTIDE PHOSPHONATE DERIVATIVES THERAVANCE, INC. (US) 2011-03-10 US disclosed
US-7728104-B2 Process for preparing glycopeptide phosphonate derivatives THERAVANCE, INC. (US) 2010-06-01 US disclosed
EP-2081917-A2 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF Abbott Laboratories (US) 2009-07-29 EP disclosed
US-6979723-B2 Process for preparing glycopeptide phosphonate derivatives THERAVANCE, INC. (US) 2005-12-27 US disclosed
EP-1419174-A4 PROCESS FOR PREPARING GLYCOPEPTIDE DERIVATIVES THERAVANCE INC (US) 2005-10-12 EP disclosed
US-20050020488-A1 Process for preparing glycopeptide phosphonate derivatives CUMBERLAND PHARMACEUTICALS INC. 2005-01-27 US disclosed
EP-1418933-A4 PROCESS FOR PREPARING GLYCOPEPTIDE PHOSPHONATE DERIVATIVES THERAVANCE INC (US) 2004-10-27 EP disclosed
EP-1418933-A2 PROCESS FOR PREPARING GLYCOPEPTIDE PHOSPHONATE DERIVATIVES Theravance, Inc. (US) 2004-05-19 EP disclosed
EP-1419174-A2 PROCESS FOR PREPARING GLYCOPEPTIDE DERIVATIVES Theravance, Inc. (US) 2004-05-19 EP disclosed
WO-2003029270-A2 PROCESS FOR PREPARING GLYCOPEPTIDE PHOSPHONATE DERIVATIVES THERAVANCE, INC. (US) 2003-04-10 WO disclosed
US-20030069391-A1 Process for preparing glycopeptide phosphonate derivatives CUMBERLAND PHARMACEUTICALS INC. 2003-04-10 US disclosed
US-20030045457-A1 Process for preparing glycopeptide derivatives CUMBERLAND PHARMACEUTICALS INC. 2003-03-06 US disclosed
WO-2003018607-A2 PROCESS FOR PREPARING GLYCOPEPTIDE DERIVATIVES THERAVANCE, INC. (US) 2003-03-06 WO disclosed