SCHEMBL6056283

SCHEMBL6056283

C[C@H]1CC(C(CN)P(=O)(O)O)C[C@@H]1C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 4/20 0.37
ERAP2 Q6P179 3/20 0.37
GABBR2 O75899 2/20 0.34
GABBR1 Q9UBS5 2/20 0.34
GABRR1 P24046 1/20 0.32
LAP3 P28838 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL5537099 1.00 ANPEP (0.37) ANPEPERAP2GABBR2GABBR1GABRR1
SCHEMBL6056274 1.00 ANPEP (0.37) ANPEPERAP2GABBR2GABBR1GABRR1
SCHEMBL7176498 0.79 ANPEP (0.33) ANPEPERAP2GABBR2GABBR1
SCHEMBL5529429 0.79 ANPEP (0.33) ANPEPERAP2GABBR2GABBR1
SCHEMBL7176500 0.79 ANPEP (0.33) ANPEPERAP2GABBR2GABBR1
SCHEMBL5528741 0.77 ALDH1A1 (0.34) ANPEPERAP2ALDH1A1
SCHEMBL5394771 0.75 TP53 (0.45) ANPEPERAP2GABBR2GABBR1ALDH1A1
SCHEMBL5386055 0.74 ANPEP (0.35) ANPEPERAP2GABBR2GABBR1GABRR1
SCHEMBL5388081 0.73 TP53 (0.48) ANPEPERAP2ALDH1A1
SCHEMBL5394744 0.73 TP53 (0.48) ANPEPERAP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1675582-A1 COMBINATION COMPRISING AN ALPHA-2-DELTA LIGAND AND AN SSRI AND/OR SNRI FOR TREATMENT OF DEPRESSION AND ANXIETY DISORDERS Warner-Lambert Company LLC (US) 2006-07-05 EP disclosed
WO-2005025563-A1 COMBINATION COMPRISING AN ALPHA-2-DELTA LIGAND AND AN SSRI AND/OR SNRI FOR TREATMENT OF DEPRESSION AND ANXIETY DISORDERS WARNER-LAMBERT COMPANY LLC (US) 2005-03-24 WO disclosed
EP-1515709-A2 USE OF AN ALPHA2DELTA LIGAND SUCH AS GABAPENTIN OR PREGABALIN FOR TREATING ATTENTION DEFICIT HYPERACTIVITY DISORDER Warner-Lambert Company LLC (US) 2005-03-23 EP disclosed
EP-1480639-A1 COMBINATIONS OF AN ALPHA-2-DELTA LIGAND WITH A SELECTIVE INHIBITOR OF CYCLOOXYGENASE-2 Warner-Lambert Company LLC (US) 2004-12-01 EP disclosed
WO-2004002462-A2 USE OF AN ALPHA2DELTA LIGAND SUCH AS GABAPENTIN OR PREGABALIN FOR TREATING TTENTION DEFICIT HYPERACTIVITY DISORDER WARNER-LAMBERT COMPANY LLC (US) 2004-01-08 WO disclosed
WO-2003070237-A1 COMBINATIONS OF AN ALPHA-2-DELTA LIGAND WITH A SELECTIVE INHIBITOR OF CYCLOOXYGENASE-2 WARNER-LAMBERT COMPANY LLC (US) 2003-08-28 WO disclosed