SCHEMBL4921729

SCHEMBL4921729

CC(C)(C)OC(=O)NC(CC(=O)N1CC(C(=O)NCc2ccccc2)C1)Cc1ccccc1F

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.47
CTSS P25774 1/20 0.47
SCN9A Q15858 7/20 0.46
ATM Q13315 2/20 0.46
PABPC1 P11940 1/20 0.43
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
PTPN1 P18031 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.40
KMT2A Q03164 2/20 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
SCHEMBL8505388 1.00 CTSK (0.47) CTSKCTSSSCN9AATMPABPC1
SCHEMBL14102471 0.83 KLK5 (0.54) ALDH1A1
SCHEMBL5225887 0.83 CTSS (0.47) CTSKCTSSSCN9APABPC1KMT2A
SCHEMBL8491789 0.83 SCN9A (0.43) CTSKCTSSSCN9ALMNAPTPN1
SCHEMBL4917495 0.83 SCN9A (0.43) CTSKCTSSSCN9ALMNAPTPN1
SCHEMBL6298469 0.83 TDP1 (0.56) CTSKCTSSSCN9AATMPTPN1
SCHEMBL8294401 0.83 TDP1 (0.56) CTSKCTSSSCN9AATMPTPN1
SCHEMBL5224763 0.82 CTSL (0.47) CTSKCTSSSCN9APABPC1PTPN1
SCHEMBL8289132 0.81 CTSS (0.46) CTSKCTSSSCN9AATMPTPN1
SCHEMBL5223869 0.80 CFD (0.42) CTSKCTSSSCN9AATMPTPN1

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 CTSK 124/4885CTSS 271/4885SCN9A 1227/4885

“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.