SCHEMBL6248952

SCHEMBL6248952

CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC(F)(F)C1)C1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 9/20 0.55
DPP7 Q9UHL4 6/20 0.55
KCNH2 Q12809 3/20 0.39
EPHX1 P07099 2/20 0.38
AAK1 Q2M2I8 1/20 0.38
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CTSL P07711 3/20 0.36
GAA P10253 1/20 0.36
CTSB P07858 1/20 0.36
CTSK P43235 1/20 0.36
ELANE P08246 1/20 0.36
PDE9A O76083 1/20 0.36
PDE1B Q01064 1/20 0.36

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
SCHEMBL6248955 1.00 DPP4 (0.55) DPP4DPP7KCNH2EPHX1AAK1
SCHEMBL6360353 0.89 DPP4 (0.44) DPP4DPP7KCNH2AAK1DPP8
SCHEMBL6359699 0.89 DPP4 (0.44) DPP4DPP7KCNH2AAK1DPP8
SCHEMBL6360357 0.89 DPP4 (0.44) DPP4DPP7KCNH2AAK1DPP8
SCHEMBL6698692 0.85 DPP4 (0.51) DPP4DPP7EPHX1AAK1HDAC4
SCHEMBL6698698 0.85 DPP4 (0.51) DPP4DPP7EPHX1AAK1HDAC4
SCHEMBL27348045 0.83 CALCRL (0.41) DPP4DPP7EPHX1AAK1HDAC4
SCHEMBL12463556 0.82 EPHX1 (0.45) EPHX1AAK1HDAC4HDAC1HDAC6
SCHEMBL22501529 0.82 EPHX1 (0.45) EPHX1AAK1HDAC4HDAC1HDAC6
SCHEMBL13412185 0.80 DPP4 (0.43) DPP4DPP7KCNH2DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1565437-A1 DIPEPTIDYL PEPTIDASE IV INHIBITING FLUORINATED CYCLIC AMIDES Pfizer Products Inc. (US) 2005-08-24 EP disclosed
US-20040110817-A1 Dipeptidyl peptidase IV inhibiting fluorinated cyclic amides PFIZER INC 2004-06-10 US disclosed
WO-2004046106-A1 DIPEPTIDYL PEPTIDASE IV INHIBITING FLUORINATED CYCLIC AMIDES PFIZER PRODUCTS INC. (US) 2004-06-03 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-20040110817-A1 Dipeptidyl peptidase IV inhibiting fluorinated cyclic amides DPP4, ALPI, DPP7 DPP4 1/4885DPP7 3/4885KCNH2 1287/4885

“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.