SCHEMBL4635265

SCHEMBL4635265

N#Cc1ccc(N2CC3C(N)C3C2)c(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.50
DPP8 Q6V1X1 2/20 0.50
DPP9 Q86TI2 2/20 0.50
DPP7 Q9UHL4 2/20 0.50
PREP P48147 1/20 0.50
HSD11B1 P28845 2/20 0.43
TRPV4 Q9HBA0 1/20 0.40
AOC3 Q16853 1/20 0.39
AR P10275 4/20 0.38
KIF11 P52732 1/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
NOTUM Q6P988 2/20 0.36
CRHR1 P34998 2/20 0.34
ELANE P08246 1/20 0.34

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
SCHEMBL4635925 0.81 DPP4 (0.47) DPP4DPP8DPP9DPP7PREP
SCHEMBL4635559 0.78 DPP4 (0.47) DPP4DPP8DPP9DPP7PREP
SCHEMBL3532873 0.78 NOTUM (0.48) DPP4DPP8DPP9DPP7PREP
SCHEMBL1963730 0.77 DPP4 (0.56) DPP4DPP8DPP9DPP7PREP
SCHEMBL250177 0.77 NOTUM (0.47) DPP4DPP8DPP9DPP7PREP
SCHEMBL4635419 0.76 DPP4 (0.49) DPP4DPP8DPP9DPP7
SCHEMBL3222955 0.76 HTR2C (0.55) DPP4DPP8DPP9DPP7PREP
SCHEMBL20830204 0.75 DRD2 (0.49) DPP4DPP8DPP9DPP7PREP
SCHEMBL4635182 0.75 DPP4 (0.50) DPP4DPP8DPP9DPP7PREP
SCHEMBL249912 0.74 NOTUM (0.51) DPP4HSD11B1TRPV4ARNOTUM

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
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
EP-1931633-A2 DERIVATIVES OF 3-AZABICYCLO[3.1.0]HEXANE AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS Ranbaxy Laboratories Limited (IN) 2008-06-18 EP disclosed
WO-2007029086-A2 DERIVATIVES OF 3-AZABICYCLO[3.1.0]HEXANE AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2007-03-15 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-20080300251-A1 Derivatives of 3-Azabicyclo[3.1.0] Hexane as Dipeptidyl Peptidase-IV Inhibitors DPP4, DPP3, DPP8 DPP4 1/4885DPP8 3/4885DPP9 5/4885

“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.