SCHEMBL2904019

SCHEMBL2904019

C[C@H]1CN(C(=O)O)C[C@@H]1C(=O)N(C)C

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 1/20 0.33
DPP4 P27487 1/20 0.32
CHRNB2 P17787 6/20 0.32
CHRNA3 P32297 6/20 0.32
CHRNA4 P43681 6/20 0.32
CHRNB3 Q05901 4/20 0.32
CHRNA6 Q15825 4/20 0.32
PDK2 Q15119 6/20 0.31
CHRNB4 P30926 2/20 0.30
CHRNA7 P36544 2/20 0.30

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
SCHEMBL2904022 1.00 TLR2 (0.33) TLR2DPP4CHRNB2CHRNA3CHRNA4
SCHEMBL2904021 1.00 TLR2 (0.33) TLR2DPP4CHRNB2CHRNA3CHRNA4
SCHEMBL15321964 0.84 MEN1 (0.32) DPP4PDK2
SCHEMBL17632223 0.79 CHRNB2 (0.35) TLR2CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL28866517 0.79 CHRNB2 (0.35) TLR2CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL2569062 0.79 DPP4 (0.39) DPP4PDK2
SCHEMBL14780353 0.76 CHRNB2 (0.37) TLR2CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL27324166 0.76 ALDH1A1 (0.33) DPP4
SCHEMBL19971695 0.72 KDM5A (0.33) DPP4
SCHEMBL19971696 0.72 KDM5A (0.33) DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2217226-B1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2015-07-22 EP disclosed
EP-2217226-A1 PEPTIDE DEFORMYLASE INHIBITORS GlaxoSmithKline LLC (US) 2010-08-18 EP disclosed
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2009-12-10 US disclosed
WO-2009061879-A1 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-05-14 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-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DHPS, PADI3 TLR2 3383/4885DPP4 180/4885CHRNB2 4880/4885

“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.