SCHEMBL290079

SCHEMBL290079

CCN1CCCC1N(C)C=O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 4/20 0.39
ADH1C P00326 3/20 0.39
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
SIGMAR1 Q99720 2/20 0.31
HTT P42858 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL21400923 0.78 SIGMAR1 (0.36) ALDH1A1L3MBTL1SIGMAR1HTT
SCHEMBL15652741 0.75 ALDH1A1 (0.33) ALDH1A1L3MBTL1SIGMAR1
SCHEMBL290078 0.74 ALDH1A1 (0.34) ALDH1A1L3MBTL1SIGMAR1HTT
SCHEMBL16495171 0.73 ALDH1A1 (0.40) ALDH1A1L3MBTL1SIGMAR1HTT
SCHEMBL9874179 0.72 SIGMAR1 (0.34) ALDH1A1SIGMAR1
SCHEMBL19924569 0.71 ALDH1A1 (0.39) ALDH1A1L3MBTL1SIGMAR1HTT
SCHEMBL9660551 0.70
SCHEMBL1116394 0.70
SCHEMBL2617060 0.70
SCHEMBL27634677 0.67 SIGMAR1 (0.30) ALDH1A1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427447-A2 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION Pike Pharma GmbH (CH) 2012-03-14 EP claimed
WO-2010128163-A2 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION PIKE PHARMA GMBH (CH) 2010-11-11 WO claimed
EP-2427447-A2 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION Pike Pharma GmbH (CH) 2012-03-14 EP disclosed
WO-2010128163-A3 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION PIKE PHARMA GMBH (CH) 2011-01-06 WO disclosed
WO-2010128163-A2 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION PIKE PHARMA GMBH (CH) 2010-11-11 WO disclosed