SCHEMBL14280844

SCHEMBL14280844

CN[C@@H](CC(=O)NC1Cc2c(C)cccc2NC1=O)Cc1ccccc1F

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 3/20 0.39
SCN9A Q15858 2/20 0.35
DPP4 P27487 7/20 0.34
CCKAR P32238 5/20 0.34
CCKBR P32239 5/20 0.34
DPP8 Q6V1X1 2/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
HTT P42858 1/20 0.32

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
SCHEMBL8274773 0.88 DPP4 (0.45) DPP4DPP8DPP9DPP7
SCHEMBL8274784 0.87 SCN9A (0.46) SCN9ACCKARCCKBR
Hydrochloric Acid SCHEMBL4918737 0.87 DPP4 (0.44) DPP4DPP8DPP9DPP7
Hydrochloric Acid SCHEMBL4913099 0.87 DPP4 (0.44) DPP4DPP8DPP9DPP7
SCHEMBL4894329 0.82 SCN9A (0.35) RIPK1SCN9ADPP4CCKARCCKBR
SCHEMBL14280842 0.82 SCN9A (0.37) RIPK1SCN9ADPP4DPP8
SCHEMBL14280845 0.81 DPP4 (0.36) SCN9ADPP4DPP8DPP9
SCHEMBL14280843 0.79 ALDH1A1 (0.37) RIPK1DPP4CCKARCCKBR
SCHEMBL14280771 0.77 DPP4 (0.45) DPP4DPP8DPP9DPP7
Hydrochloric Acid SCHEMBL4891134 0.76 DPP4 (0.45) DPP4DPP8DPP9DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080009512-A1 Tetrahydroquinolones and Aza-Analogues Thereof for Use as Dpp-IV Inhibitors in the Treatment of Diabetes ASTRAZENECA AB (SE) 2008-01-10 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-20080009512-A1 Tetrahydroquinolones and Aza-Analogues Thereof for Use as Dpp-IV Inhibitors in the Treatment of Diabetes DPP4, DPP8, DPP3 RIPK1 3999/4885SCN9A 718/4885DPP4 1/4885

“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.