SCHEMBL713741

SCHEMBL713741

CC(C)NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C#N

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.64
DPP8 Q6V1X1 13/20 0.64
DPP9 Q86TI2 8/20 0.64
DPP7 Q9UHL4 7/20 0.64
PREP P48147 2/20 0.61
FAP Q12884 6/20 0.60

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
SCHEMBL719969 1.00 DPP4 (0.64) DPP4DPP8DPP9DPP7PREP
SCHEMBL720421 0.86 DPP4 (0.63) DPP4DPP8DPP9DPP7PREP
SCHEMBL720420 0.86 DPP4 (0.63) DPP4DPP8DPP9DPP7PREP
SCHEMBL14392567 0.79 DPP4 (0.80) DPP4DPP8DPP9DPP7PREP
SCHEMBL6453066 0.78 DPP4 (1.00) DPP4DPP8DPP9DPP7FAP
SCHEMBL9450506 0.77 DPP4 (0.50) DPP4DPP8DPP9DPP7PREP
SCHEMBL5530143 0.77 DPP4 (0.59) DPP4DPP8DPP7PREP
SCHEMBL719153 0.76 DPP4 (0.62) DPP4DPP8DPP9DPP7PREP
SCHEMBL14392722 0.76 DPP4 (1.00) DPP4DPP8DPP9DPP7FAP
SCHEMBL7444796 0.76 DPP4 (0.52) DPP4DPP8DPP9DPP7FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053222-A1 Novel Metabolic Disease Therapy THE UNIVERSITY OF SYDNEY (AU) 2012-03-01 US claimed
US-20100081701-A1 FAP inhibitors VANTIA LIMITED (GB) 2010-04-01 US claimed
EP-1919864-A2 FAP INHIBITORS Ferring B.V. (NL) 2008-05-14 EP claimed
WO-2007085895-A2 FAP INHIBITORS FERRING B.V. (US) 2007-08-02 WO claimed
EP-1760076-A1 FAP Inhibitors FERRING B.V. (NL) 2007-03-07 EP claimed
US-8183280-B2 FAP inhibitors VANTIA LIMITED (GB) 2012-05-22 US disclosed
US-8183280-B2 FAP inhibitors VANTIA LIMITED (GB) 2012-05-22 US disclosed
US-8183280-B2 FAP inhibitors VANTIA LIMITED (GB) 2012-05-22 US disclosed
US-20120053222-A1 Novel Metabolic Disease Therapy THE UNIVERSITY OF SYDNEY (AU) 2012-03-01 US disclosed
EP-2389176-A1 NOVEL METABOLIC DISEASE THERAPY The University Of Sydney (AU) 2011-11-30 EP disclosed
US-20110253961-A1 Combined Guardrail and Cable Safety Systems TRINITY INDUSTRIES, INC. (US) 2011-10-20 US disclosed
WO-2010083570-A1 NOVEL METABOLIC DISEASE THERAPY THE UNIVERSITY OF SYDNEY (AU) 2010-07-29 WO disclosed
US-20100081701-A1 FAP inhibitors VANTIA LIMITED (GB) 2010-04-01 US disclosed
US-20100081701-A1 FAP inhibitors VANTIA LIMITED (GB) 2010-04-01 US disclosed
US-20100081701-A1 FAP inhibitors VANTIA LIMITED (GB) 2010-04-01 US disclosed
WO-2007085895-A2 FAP INHIBITORS FERRING B.V. (US) 2007-08-02 WO disclosed
EP-1760076-A1 FAP Inhibitors FERRING B.V. (NL) 2007-03-07 EP disclosed
EP-1760076-A1 FAP Inhibitors FERRING B.V. (NL) 2007-03-07 EP 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-20100081701-A1 FAP inhibitors FAP, APC, SERPINB1 DPP4 256/4885DPP8 227/4885DPP9 59/4885
US-20120053222-A1 Novel Metabolic Disease Therapy FAP, G6PC1, FBP1 DPP4 11/4885DPP8 56/4885DPP9 51/4885

“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.