SCHEMBL4917495

SCHEMBL4917495

CC(C)(C)OC(=O)NC(CC(=O)N1CC(C(=O)Nc2ccccn2)C1)Cc1ccccc1F

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 12/20 0.43
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
SCN10A Q9Y5Y9 1/20 0.41
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
PSMB5 P28074 1/20 0.39
PTPN1 P18031 1/20 0.38

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
SCHEMBL8491789 1.00 SCN9A (0.43) SCN9ACTSSCTSKSCN10ALMNA
SCHEMBL8505388 0.83 CTSK (0.47) SCN9ACTSSCTSKSCN10ALMNA
SCHEMBL4921729 0.83 CTSK (0.47) SCN9ACTSSCTSKSCN10ALMNA
SCHEMBL4919755 0.81 KDM4E (0.43) SCN9ACTSSCTSKSCN10APOLB
SCHEMBL4957620 0.81 KDM4E (0.43) SCN9ACTSSCTSKSCN10APOLB
SCHEMBL8493039 0.81 SCN9A (0.45) SCN9ACTSSCTSK
SCHEMBL8474235 0.81 SCN9A (0.45) SCN9ACTSSCTSK
SCHEMBL5772714 0.80 DPP4 (0.52)
SCHEMBL5772718 0.80 DPP4 (0.52)
SCHEMBL5225887 0.80 CTSS (0.47) SCN9ACTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080275086-A1 Dpp-Iv Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2008-11-06 US disclosed
EP-1858846-A1 DPP-IV INHIBITORS Santhera Pharmaceuticals (Schweiz) GmbH (CH) 2007-11-28 EP disclosed
WO-2006097175-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2006-09-21 WO disclosed
EP-1702916-A1 DPP-IV inhibitors Santhera Pharmaceuticals (Schweiz) GmbH (CH) 2006-09-20 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 (1 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-20080275086-A1 Dpp-Iv Inhibitors DPP4, DPP7, DPP3 SCN9A 1227/4885CTSS 271/4885CTSK 124/4885

“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.