SCHEMBL4663334

SCHEMBL4663334

CC(C)(C)OC(=O)NC(CC(=O)N1CCC[C@H]1COCc1ccccc1)Cc1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 13/20 0.49
KLK5 Q9Y337 1/20 0.48
ACE P12821 1/20 0.46
DPP8 Q6V1X1 1/20 0.45
DPP9 Q86TI2 1/20 0.45
DPP7 Q9UHL4 1/20 0.45
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
CMA1 P23946 2/20 0.43
SCN9A Q15858 2/20 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
SCHEMBL8290087 1.00 DPP4 (0.49) DPP4KLK5ACEDPP8DPP9
SCHEMBL7852576 0.90 DPP4 (0.61) DPP4KLK5ACEDPP8DPP9
SCHEMBL8273836 0.88 DPP4 (0.48) DPP4DPP8DPP9DPP7
SCHEMBL7852591 0.87 DPP4 (0.49) DPP4KLK5DPP8DPP9DPP7
SCHEMBL8373795 0.87 DPP4 (0.49) DPP4KLK5DPP8DPP9DPP7
SCHEMBL4955095 0.87 DPP4 (0.51) DPP4KLK5DPP8DPP9DPP7
SCHEMBL8289111 0.87 DPP4 (0.51) DPP4KLK5DPP8DPP9DPP7
SCHEMBL8290132 0.85 DPP4 (0.51) DPP4KLK5ACEDPP8DPP9
SCHEMBL8373777 0.84 KLK5 (0.47) DPP4KLK5ACEDPP8DPP9
SCHEMBL7858468 0.84 KLK5 (0.47) DPP4KLK5ACEDPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080176838-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (DEUTSCHLAND) AG (DE) 2008-07-24 US disclosed
US-20080027035-A1 Dpp-Iv Inhibitors GRAFFINITY PHARMACEUTICALS AG (DE) 2008-01-31 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-20080027035-A1 Dpp-Iv Inhibitors DPP4, DPP7, DPP3 DPP4 1/4885KLK5 84/4885ACE 15/4885
US-20080176838-A1 Dpp-IV Inhibitors DPP4, DPP9, DPP7 DPP4 1/4885KLK5 1019/4885ACE 20/4885

“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.