SCHEMBL670375

SCHEMBL670375

NC(=O)C1CCCN1C(=O)CCl

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 8/20 0.49
ACE P12821 1/20 0.44
HTR1A P08908 3/20 0.43
HTR7 P34969 3/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL1239264 1.00 DPP4 (0.49) DPP4ACEHTR1AHTR7ALDH1A1
SCHEMBL3396586 1.00 DPP4 (0.49) DPP4ACEHTR1AHTR7ALDH1A1
SCHEMBL22481429 0.95 DPP4 (0.45) DPP4ACEHTR1AHTR7
SCHEMBL6168040 0.89 ALDH1A1 (0.41) DPP4HTR1AHTR7ALDH1A1LMNA
SCHEMBL8772871 0.83 DPP4 (0.56) DPP4ACEHTR1AHTR7
SCHEMBL1170836 0.83 ACE (0.62) ACELMNA
SCHEMBL1493753 0.83 DPP4 (0.47) DPP4ACEHTR1AHTR7
SCHEMBL20839701 0.83 ACE (0.62) ACELMNA
SCHEMBL8772866 0.83 DPP4 (0.56) DPP4ACEHTR1AHTR7
SCHEMBL3200494 0.83 ACE (0.62) ACELMNA

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 57 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114441657-A Method for detecting vildagliptin genotoxic impurities 康普药业股份有限公司 2022-05-06 CN claimed
WO-2011101861-A1 PROCESS FOR PREPARATION OF DPP-IV INHIBITORS MSN LABORATORIES LIMITED (IN) 2011-08-25 WO claimed
WO-2011012322-A9 SYNTHESIS AND USE OF VILDAGLIPTIN FOR THE PREPARATION OF PHARMACEUTICAL DOSAGE FORMS KRKA, D.D., NOVO MESTO (SI) 2011-08-11 WO claimed
CN-113264863-B Preparation method of (S) -1- (2-chloroacetyl) pyrrolidine-2-carbonitrile with high chiral purity 合肥利夫生物科技有限公司 2024-11-22 CN disclosed
CN-118619868-A Preparation method of deuterated vildagliptin bulk drug 山东丰金制药有限公司 2024-09-10 CN disclosed
CN-115650984-A Preparation method of anagliptin 江苏君若药业有限公司 2023-01-31 CN disclosed
CN-115586276-A Method for detecting genotoxic impurities of vildagliptin 海南通用三洋药业有限公司 2023-01-10 CN disclosed
CN-112028806-B Synthetic method of vildagliptin intermediate 河北合佳医药科技集团股份有限公司 2022-09-30 CN disclosed
CN-114441657-A Method for detecting vildagliptin genotoxic impurities 康普药业股份有限公司 2022-05-06 CN disclosed
CN-114441657-A Method for detecting vildagliptin genotoxic impurities 康普药业股份有限公司 2022-05-06 CN disclosed
CN-110642769-B Preparation method of vildagliptin 烟台万润药业有限公司 2022-03-25 CN disclosed
WO-2010017418-A1 PRODRUGS OF FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-11 WO disclosed
WO-2010017418-A1 PRODRUGS OF FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-11 WO disclosed
US-20080269189-A1 Method for Avoiding Edema in the Treatment or Prevention of Ppary-Responsive Diseases, Including Cancer DIATEX, INC. 2008-10-30 US disclosed
US-20080269189-A1 Method for Avoiding Edema in the Treatment or Prevention of Ppary-Responsive Diseases, Including Cancer DIATEX, INC. 2008-10-30 US disclosed
US-20080194646-A1 Methods For Avoiding Edema in the Treatment of Metabolic, Inflammatory, and Cardiovascular Disorders DIATEX, INC. 2008-08-14 US disclosed
US-20080194646-A1 Methods For Avoiding Edema in the Treatment of Metabolic, Inflammatory, and Cardiovascular Disorders DIATEX, INC. 2008-08-14 US disclosed
EP-1888571-A2 NEW SALT AND POLYMORPHS OF A DPP-IV INHIBITOR F. Hoffmann-Roche AG (CH) 2008-02-20 EP disclosed
WO-2006100181-A2 NEW SALT AND POLYMORPHS OF A DPP-IV INHIBITOR F. HOFFMANN-LA ROCHE AG (CH) 2006-09-28 WO disclosed
US-20060217428-A1 Salt and polymorphs of a DPPIV inhibitor HOFFMANN-LA ROCHE INC. 2006-09-28 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 (3 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-20080269189-A1 Method for Avoiding Edema in the Treatment or Prevention of Ppary-Responsive Diseases, Including Cancer PPARG, PPARA, PPARD DPP4 765/4885ACE 1985/4885HTR1A 3250/4885
US-20080194646-A1 Methods For Avoiding Edema in the Treatment of Metabolic, Inflammatory, and Cardiovascular Disorders PPARG, PPARA, PPARD DPP4 200/4885ACE 423/4885HTR1A 2251/4885
US-20060217428-A1 Salt and polymorphs of a DPPIV inhibitor DPP4, DPP3, DPP9 DPP4 1/4885ACE 28/4885HTR1A 966/4885

“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.