SCHEMBL1377585

SCHEMBL1377585

CC#CC1CCC(C#N)N1C(=O)CNC1CCC[C@@H]1O

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.70

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
SCHEMBL647858 1.00 DPP4 (0.70) DPP4
SCHEMBL647778 0.85 DPP4 (0.68) DPP4
SCHEMBL648375 0.85 DPP4 (0.95) DPP4
SCHEMBL1380368 0.85 DPP4 (0.95) DPP4
SCHEMBL648103 0.82 DPP4 (1.00) DPP4
SCHEMBL1377320 0.82 DPP4 (1.00) DPP4
SCHEMBL6201514 0.73 DPP4 (0.62) DPP4
SCHEMBL647079 0.73 DPP4 (0.62) DPP4
SCHEMBL647582 0.72 DPP4 (0.83) DPP4
SCHEMBL1377808 0.72 DPP4 (0.83) DPP4

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
JP-4712387-B2 2011-06-29 JP claimed
EP-1560811-A2 PHARMACEUTICAL COMPOSITIONS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE-IV (DPP-IV) Abbott Laboratories (US) 2005-08-10 EP claimed
WO-2004026822-A2 PHARMACEUTICAL COMPOSITIONS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE-IV (DPP-IV) ABBOTT LABORATORIES (US) 2004-04-01 WO claimed
EP-1560811-A2 PHARMACEUTICAL COMPOSITIONS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE-IV (DPP-IV) Abbott Laboratories (US) 2005-08-10 EP disclosed
WO-2004026822-A2 PHARMACEUTICAL COMPOSITIONS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE-IV (DPP-IV) ABBOTT LABORATORIES (US) 2004-04-01 WO disclosed