SCHEMBL15856041

SCHEMBL15856041

NC(=O)C1CCCN1CC(=O)N1CCCC1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 8/20 0.44
▸ ACE P12821 2/20 0.41
▸ HTR1A P08908 3/20 0.40
▸ HTR7 P34969 3/20 0.40

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
SCHEMBL6787907 0.81 ACE (0.58) ACE
SCHEMBL6787913 0.81 ACE (0.58) ACE
SCHEMBL27146148 0.80 POLB (0.43) DPP4ACE
SCHEMBL27146149 0.80 POLB (0.43) DPP4ACE
SCHEMBL8772871 0.80 DPP4 (0.56) DPP4ACEHTR1AHTR7
SCHEMBL1493753 0.80 DPP4 (0.47) DPP4ACEHTR1AHTR7
SCHEMBL8772866 0.80 DPP4 (0.56) DPP4ACEHTR1AHTR7
Hydrochloric Acid SCHEMBL19692659 0.79 DPP4 (0.54) DPP4ACEHTR1AHTR7
Bromide SCHEMBL9464396 0.79 DPP4 (0.54) DPP4ACEHTR1AHTR7
SCHEMBL7256889 0.79 DPP4 (0.46) DPP4ACEHTR1AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014102815-A1 IMPROVED PROCESS FOR PREPARATION OF VILDAGLIPTIN GLENMARK PHARMACEUTICALS LIMITED; GLENMARK GENERICS LIMITED (IN) 2014-07-03 — — WO disclosed
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