SCHEMBL5545234

SCHEMBL5545234

N#Cc1ccc(NC[C@@H]2CC[C@H](N)C2)nc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.42
EGLN2 Q96KS0 3/20 0.42
PRKCQ Q04759 1/20 0.42
DPP4 P27487 7/20 0.41
DPP7 Q9UHL4 3/20 0.41
DPP8 Q6V1X1 2/20 0.41
CYP2D6 P10635 1/20 0.41
DPP9 Q86TI2 1/20 0.41
CHEK1 O14757 1/20 0.39
CHEK2 O96017 1/20 0.39
JAK3 P52333 2/20 0.38
JAK2 O60674 1/20 0.38

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
SCHEMBL5543229 1.00 USP30 (0.42) USP30EGLN2PRKCQDPP4DPP7
SCHEMBL5543235 1.00 USP30 (0.42) USP30EGLN2PRKCQDPP4DPP7
SCHEMBL5549920 1.00 USP30 (0.42) USP30EGLN2PRKCQDPP4DPP7
SCHEMBL5545238 1.00 USP30 (0.42) USP30EGLN2PRKCQDPP4DPP7
SCHEMBL5549932 1.00 USP30 (0.42) USP30EGLN2PRKCQDPP4DPP7
SCHEMBL15739611 0.87 EGLN2 (0.51) USP30EGLN2DPP4DPP7DPP8
SCHEMBL27304307 0.78 CHEK1 (0.57) USP30EGLN2PRKCQDPP4DPP7
SCHEMBL27304051 0.77 EGLN2 (0.43) USP30EGLN2DPP4DPP7DPP8
SCHEMBL5548760 0.77 DPP4 (0.42) USP30DPP4DPP7DPP8CYP2D6
SCHEMBL5548764 0.77 DPP4 (0.42) USP30DPP4DPP7DPP8CYP2D6

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-20050192324-A1 Novel dipeptidyl peptidase IV inhibitors; processes for their preparation and compositions thereof GLENMARK PHARMACEUTICALS LTD. (IN) 2005-09-01 US claimed
US-7230002-B2 Dipeptidyl peptidase IV inhibitors; processes for their preparation and compositions thereof GLENMARK PHARMACEUTICALS LTD. (IN) 2007-06-12 US disclosed
US-20050192324-A1 Novel dipeptidyl peptidase IV inhibitors; processes for their preparation and compositions thereof GLENMARK PHARMACEUTICALS LTD. (IN) 2005-09-01 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-20050192324-A1 Novel dipeptidyl peptidase IV inhibitors; processes for their preparation and compositions thereof DPP4, DPP3, DPP7 USP30 896/4885EGLN2 1746/4885PRKCQ 1357/4885

“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.