SCHEMBL4913602

SCHEMBL4913602

CC(C)(C)OC(=O)N[C@@H](CCCN)C(=O)N1CCSC1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 6/20 0.54
DPP4 P27487 4/20 0.54
PREP P48147 1/20 0.52
ITGB3 P05106 10/20 0.52
ITGA2B P08514 10/20 0.52
DPP8 Q6V1X1 2/20 0.50
DPP9 Q86TI2 2/20 0.50
TSHR P16473 1/20 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
SCHEMBL10074274 0.97 ITGB3 (0.56) DPP7DPP4PREPITGB3ITGA2B
SCHEMBL4906556 0.97 ITGB3 (0.56) DPP7DPP4PREPITGB3ITGA2B
SCHEMBL4913612 0.86 PREP (0.50) DPP7DPP4PREPITGB3ITGA2B
SCHEMBL6100308 0.86 PREP (0.52) DPP7DPP4PREPITGB3ITGA2B
SCHEMBL6100302 0.85 PREP (0.53) DPP7DPP4PREPITGB3ITGA2B
SCHEMBL6890952 0.84 PREP (0.48) DPP7DPP4PREPITGB3ITGA2B
SCHEMBL4917735 0.84 ITGB3 (0.61) ITGB3ITGA2BTSHR
SCHEMBL5351068 0.84 PREP (0.57) DPP7DPP4PREPITGB3ITGA2B
SCHEMBL27586353 0.84 PREP (0.57) DPP7DPP4PREPITGB3ITGA2B
SCHEMBL6872889 0.82 PREP (0.55) DPP7DPP4PREPITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255126-A1 Inhibitors of post-proline cleaving proteases FERRING B.V. 2008-10-16 US disclosed
US-7335677-B2 Inhibitors of dipeptidyl peptidase IV FERRING B.V. (NL) 2008-02-26 US disclosed
US-7189728-B2 Inhibitors of dipeptidyl peptidase IV FERRING, BV (NL) 2007-03-13 US disclosed
US-7144886-B2 Dipeptidyl peptidase IV (DP-IV) inhibitors as anti-diabetic agents FERRING B.V. (NL) 2006-12-05 US disclosed
US-7125863-B2 Inhibitors of dipeptidyl peptidase IV FERRING BV (NL) 2006-10-24 US disclosed
EP-1693365-A1 Inhibitors of dipeptidyl peptidase IV FERRING B.V. (NL) 2006-08-23 EP disclosed
US-20050043299-A1 Inhibitors of dipeptidyl peptidase iv FERRING B. V. 2005-02-24 US disclosed
US-20050004205-A1 Novel dipeptidyl peptidase iv (dp-iv) inhibitors as anti-diabetic agents FERRING B.V. (NL) 2005-01-06 US disclosed
EP-1280797-B1 INHIBITORS OF DIPEPTIDYL PEPTIDASE IV FERRING BV (NL) 2004-10-13 EP disclosed
EP-1446116-A1 INHIBITORS OF DIPEPTIDYL PEPTIDASE IV FERRING B.V. (NL) 2004-08-18 EP disclosed
US-20040082497-A1 Inhibitors of dipeptidyl peptidase IV FERRING BV (NL) 2004-04-29 US disclosed
US-20030216450-A1 Inhibitors of dipeptidyl peptidase IV FERRING BV (NL) 2003-11-20 US disclosed
WO-2003035057-A1 INHIBITORS OF DIPEPTIDYL PEPTIDASE IV FERRING B.V. (NL) 2003-05-01 WO 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 (5 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-20030216450-A1 Inhibitors of dipeptidyl peptidase IV DPP4, DPP7, DPP8 DPP7 2/4885DPP4 1/4885PREP 117/4885
US-20040082497-A1 Inhibitors of dipeptidyl peptidase IV DPP4, DPP7, DPP3 DPP7 2/4885DPP4 1/4885PREP 27/4885
US-20050004205-A1 Novel dipeptidyl peptidase iv (dp-iv) inhibitors as anti-diabetic agents DPP4, DPP8, DPP3 DPP7 4/4885DPP4 1/4885PREP 30/4885
US-20050043299-A1 Inhibitors of dipeptidyl peptidase iv DPP4, DPP9, DPP3 DPP7 4/4885DPP4 1/4885PREP 7/4885
US-20080255126-A1 Inhibitors of post-proline cleaving proteases PREP, PEPD, DPP4 DPP7 7/4885DPP4 3/4885PREP 1/4885

“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.