SCHEMBL4896729

SCHEMBL4896729

COc1ccc(C(=O)N2CC3C(C2)C3NCC(=O)N2CCC[C@H]2C#N)cc1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PREP P48147 6/20 0.55
DPP4 P27487 12/20 0.54
DPP8 Q6V1X1 4/20 0.51
DPP9 Q86TI2 4/20 0.51
FAP Q12884 1/20 0.49
DPP7 Q9UHL4 1/20 0.49

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
SCHEMBL4888951 0.90 PREP (0.68) PREPDPP4DPP8DPP9DPP7
SCHEMBL4889074 0.89 DPP4 (0.52) PREPDPP4DPP8DPP9
SCHEMBL4899042 0.88 PREP (0.68) PREPDPP4DPP8DPP9
SCHEMBL4669072 0.88 DPP4 (0.53) PREPDPP4DPP8DPP9FAP
SCHEMBL4893801 0.87 DPP4 (0.57) PREPDPP4DPP8DPP9DPP7
SCHEMBL4896136 0.87 DPP4 (0.53) PREPDPP4DPP8DPP9
SCHEMBL4893396 0.87 DPP4 (0.57) PREPDPP4DPP8DPP9
SCHEMBL4893262 0.87 PREP (0.52) PREPDPP4DPP8DPP9
SCHEMBL4889041 0.86 PREP (0.57) PREPDPP4DPP8DPP7
SCHEMBL4635280 0.86 PREP (0.57) PREPDPP4DPP8DPP7

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 2 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
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.