SCHEMBL269285

SCHEMBL269285

COCNC(=O)C(Cc1cc(C)ccc1F)NC(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSS P25774 15/20 0.56
CTSK P43235 13/20 0.56
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CTSL P07711 4/20 0.45
CTSB P07858 3/20 0.45
SCN9A Q15858 3/20 0.44

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
SCHEMBL269629 0.89 MAPT (0.49) CTSSCTSKMAPTSMN1; SMN2CTSL
SCHEMBL4925245 0.87 CTSS (0.54) CTSSCTSKCTSLCTSB
SCHEMBL268699 0.84 PTPN1 (0.54) CTSSCTSKMAPTSMN1; SMN2SCN9A
SCHEMBL268970 0.84 CTSS (0.55) CTSSCTSKCTSLCTSBSCN9A
SCHEMBL268518 0.82 CTSS (0.49) CTSSCTSKMAPTSMN1; SMN2SCN9A
SCHEMBL269284 0.81 JAK3 (0.47) CTSSCTSKMAPTSMN1; SMN2CTSL
SCHEMBL269354 0.81 CTSS (0.60) CTSSCTSKCTSLCTSB
SCHEMBL268270 0.80 CTSS (0.57) CTSSCTSKMAPTSMN1; SMN2CTSL
SCHEMBL3992377 0.80 SCN9A (0.53) CTSSCTSKCTSLCTSBSCN9A
SCHEMBL4600460 0.80 CTSL (0.53) CTSSCTSKMAPTCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133907-B2 Type II diabetes, obesity, hyperglycemia and a lipid disorder selected from dyslipidemia, hyperlipidemia, hypertriglyceridemia, hypercholesterolemia, low HDL and high LDL; additionally comprising metformin ELI LILLY AND COMPANY (US) 2012-03-13 US disclosed
EP-1912946-B1 PYRIDINE DERIVATIVES AS DIPEPTEDYL PEPTIDASE INHIBITORS LILLY CO ELI (US) 2009-05-27 EP disclosed
US-20080214616-A1 Pyridine Derivatives as Dipeptedyl Peptidase Inhibitors ELI LILLY AND COMPANY 2008-09-04 US disclosed
EP-1912946-A1 PYRIDINE DERIVATIVES AS DIPEPTEDYL PEPTIDASE INHIBITORS Eli Lilly and Company (US) 2008-04-23 EP disclosed
WO-2007015767-A1 PYRIDINE DERIVATIVES AS DIPEPTEDYL PEPTIDASE INHIBITORS ELI LILLY AND COMPANY (US) 2007-02-08 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 (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-20080214616-A1 Pyridine Derivatives as Dipeptedyl Peptidase Inhibitors DPP4, DPP3, DPP7 CTSS 1680/4885CTSK 2589/4885MAPT 4612/4885

“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.