SCHEMBL3319718

SCHEMBL3319718

C[C@@H](N)C(=O)N1CC[CH]CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.41
DPP7 Q9UHL4 4/20 0.41
DPP8 Q6V1X1 2/20 0.41
CYP3A4 P08684 1/20 0.38
SMYD3 Q9H7B4 12/20 0.38
FAP Q12884 2/20 0.37
PREP P48147 1/20 0.37
DPP9 Q86TI2 1/20 0.37
HRH2 P25021 2/20 0.35
HRH1 P35367 2/20 0.35
HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL3311754 1.00 DPP4 (0.41) DPP4DPP7DPP8CYP3A4SMYD3
SCHEMBL28752306 0.83 DPP4 (0.46) DPP4DPP7DPP8FAPPREP
SCHEMBL1587326 0.82 CHRNB2 (0.42) DPP4DPP7DPP8
SCHEMBL4072047 0.80 ALDH1A1 (0.35) DPP4DPP7DPP8CYP3A4
SCHEMBL27848373 0.80 ALDH1A1 (0.35) DPP4DPP7DPP8CYP3A4
SCHEMBL1098525 0.80 ALDH1A1 (0.35) DPP4DPP7DPP8CYP3A4
SCHEMBL2768507 0.79 DPP4 (0.44) DPP4DPP7DPP8SMYD3FAP
SCHEMBL14656016 0.79
SCHEMBL1189333 0.79 DPP4 (0.44) DPP4DPP7DPP8SMYD3FAP
SCHEMBL26644129 0.79

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
WO-2010049731-A1 PYRAZOLO- AND IMIDAZOPYRIDINYLPYRIMIDINEAMINES AS IGF-1R TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2010-05-06 WO disclosed
US-20100105655-A1 NOVEL COMPOUNDS 515 ASTRAZENECA AB 2010-04-29 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-20100105655-A1 NOVEL COMPOUNDS 515 TYMS, ABCG2, UMPS DPP4 694/4885DPP7 904/4885DPP8 947/4885

“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.