Vildagliptin

Vildagliptin

SCHEMBL671629

N#C[C@H]1CCCN1C(=O)CNC12CC3CC(CC(O)(C3)C1)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DPP4

The experimentally established mechanism targets of Vildagliptin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 known ✓ P27487 17/20 1.00
FAP Q12884 1/20 1.00
DPP8 Q6V1X1 1/20 1.00
DPP9 Q86TI2 1/20 1.00
PREP P48147 1/20 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
Vildagliptin SCHEMBL29369942 1.00 DPP4 (1.00) DPP4FAPDPP8DPP9PREP
Vildagliptin SCHEMBL27193113 1.00 DPP4 (1.00) DPP4FAPDPP8DPP9PREP
Vildagliptin SCHEMBL10031674 1.00 DPP4 (1.00) DPP4FAPDPP8DPP9PREP
Vildagliptin SCHEMBL16153676 1.00 DPP4 (1.00) DPP4FAPDPP8DPP9PREP
Vildagliptin SCHEMBL665401 1.00 DPP4 (1.00) DPP4FAPDPP8DPP9PREP
Vildagliptin SCHEMBL16155482 1.00 DPP4 (1.00) DPP4FAPDPP8DPP9PREP
Vildagliptin SCHEMBL16579 1.00 DPP4 (1.00) DPP4FAPDPP8DPP9PREP
Vildagliptin SCHEMBL16823370 1.00 DPP4 (1.00) DPP4FAPDPP8DPP9PREP
Vildagliptin SCHEMBL665400 1.00 DPP4 (1.00) DPP4FAPDPP8DPP9PREP
Vildagliptin SCHEMBL354910 1.00 DPP4 (1.00) DPP4FAPDPP8DPP9PREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080167479-A1 PROCESS FOR PREPARING VILDAGLIPTIN MEDICHEM, S.A. (ES) 2008-07-10 US claimed
US-20170073345-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DIABETES AND PRE-DIABETES ALAPATI MOHAN MURALI (IN) 2017-03-16 US disclosed
US-20170073345-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DIABETES AND PRE-DIABETES ALAPATI MOHAN MURALI (IN) 2017-03-16 US disclosed
WO-2015145467-A1 AN IMPROVED PROCESS FOR PREPARING VILDAGLIPTIN LAURUS LABS PRIVATE LIMITED (IN) 2015-10-01 WO disclosed
WO-2014102815-A1 IMPROVED PROCESS FOR PREPARATION OF VILDAGLIPTIN GLENMARK PHARMACEUTICALS LIMITED; GLENMARK GENERICS LIMITED (IN) 2014-07-03 WO disclosed
WO-2012022994-A1 PREPARATION PROCESS OF VILDAGLIPTIN EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2012-02-23 WO disclosed
WO-2010022690-A2 A METHOD OF PREPARATION OF HIGHLY PURE VILDAGLIPTIN ZENTIVA, K.S. (CZ) 2010-03-04 WO disclosed
US-20080167479-A1 PROCESS FOR PREPARING VILDAGLIPTIN MEDICHEM, S.A. (ES) 2008-07-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170073345-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DIABETES AND PRE-DIABETES DPP4, SLC5A1, SLC5A2 DPP4 1/4885FAP 127/4885DPP8 19/4885
US-20080167479-A1 PROCESS FOR PREPARING VILDAGLIPTIN VIL1, VIP, DPP7 DPP4 4/4885FAP 164/4885DPP8 9/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.