SCHEMBL4636747

SCHEMBL4636747

N#C[C@@H]1CC(F)(F)CN1C(=O)CNC1C2CN(C(=O)O)CC21

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PREP P48147 14/20 0.60
DPP4 P27487 7/20 0.60
DPP8 Q6V1X1 5/20 0.60
DPP9 Q86TI2 5/20 0.60
DPP7 Q9UHL4 4/20 0.60
FAP Q12884 9/20 0.46
PITRM1 Q5JRX3 1/20 0.43

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
SCHEMBL4636746 1.00 PREP (0.60) PREPDPP4DPP8DPP9DPP7
SCHEMBL4888793 0.83 PREP (0.57) PREPDPP4DPP8DPP9DPP7
SCHEMBL4635478 0.82 PREP (0.59) PREPDPP4DPP8DPP9DPP7
SCHEMBL4635402 0.82 PREP (0.59) PREPDPP4DPP8DPP9DPP7
SCHEMBL4634954 0.81 PREP (0.62) PREPDPP4DPP8DPP9DPP7
SCHEMBL4634955 0.81 PREP (0.62) PREPDPP4DPP8DPP9DPP7
SCHEMBL4635257 0.81 PREP (0.57) PREPDPP4DPP8DPP9DPP7
SCHEMBL4635080 0.81 PREP (0.57) PREPDPP4DPP8DPP9DPP7
SCHEMBL4894440 0.81 PREP (0.57) PREPDPP4DPP8DPP9DPP7
SCHEMBL4894739 0.79 DPP4 (0.67) PREPDPP4DPP8DPP9DPP7

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-20080300251-A1 Derivatives of 3-Azabicyclo[3.1.0] Hexane as Dipeptidyl Peptidase-IV Inhibitors RANBAXY LABORATORIES LIMITED (IN) 2008-12-04 US claimed
EP-1931633-A2 DERIVATIVES OF 3-AZABICYCLO[3.1.0]HEXANE AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS Ranbaxy Laboratories Limited (IN) 2008-06-18 EP claimed
WO-2007029086-A2 DERIVATIVES OF 3-AZABICYCLO[3.1.0]HEXANE AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2007-03-15 WO claimed
US-20080300251-A1 Derivatives of 3-Azabicyclo[3.1.0] Hexane as Dipeptidyl Peptidase-IV Inhibitors RANBAXY LABORATORIES LIMITED (IN) 2008-12-04 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 (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-20080300251-A1 Derivatives of 3-Azabicyclo[3.1.0] Hexane as Dipeptidyl Peptidase-IV Inhibitors DPP4, DPP3, DPP8 PREP 21/4885DPP4 1/4885DPP8 3/4885

“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.