SCHEMBL1189333

SCHEMBL1189333

C[C@@H](N)C(=O)N1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 9/20 0.44
DPP7 Q9UHL4 7/20 0.44
FAP Q12884 2/20 0.44
PREP P48147 1/20 0.44
DPP8 Q6V1X1 1/20 0.44
DPP9 Q86TI2 1/20 0.44
SMYD3 Q9H7B4 1/20 0.43
HPGD P15428 1/20 0.42
ALDH1A1 P00352 3/20 0.41
HTT P42858 1/20 0.41
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP8 P22894 1/20 0.40

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
SCHEMBL389573 1.00 DPP4 (0.44) DPP4DPP7FAPPREPDPP8
SCHEMBL2768507 1.00 DPP4 (0.44) DPP4DPP7FAPPREPDPP8
SCHEMBL16935735 0.98 DPP4 (0.46) DPP4DPP7FAPPREPDPP8
Hydrochloric Acid SCHEMBL9653875 0.98 DPP4 (0.43) DPP4DPP7FAPPREPDPP8
SCHEMBL5891316 0.98 DPP4 (0.46) DPP4DPP7FAPPREPDPP8
Hydrochloric Acid SCHEMBL4502967 0.98 DPP4 (0.43) DPP4DPP7FAPPREPDPP8
SCHEMBL8612552 0.98 DPP4 (0.46) DPP4DPP7FAPPREPDPP8
SCHEMBL856280 0.98 DPP4 (0.46) DPP4DPP7FAPPREPDPP8
Hydrochloric Acid SCHEMBL3947769 0.95 DPP4 (0.45) DPP4DPP7FAPPREPDPP8
SCHEMBL14656016 0.95

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8518945-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LA ROCHE INC. (US) 2013-08-27 US claimed
EP-2955233-A1 Proteinase K inhibitors, methods and compositions therefor Life Technologies Corporation (US) 2015-12-16 EP disclosed
EP-2367954-B1 PROTEINASE K INHIBITORS, METHODS AND COMPOSITIONS THEREFOR LIFE TECHNOLOGIES CORP (US) 2015-02-18 EP disclosed
US-8518945-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LA ROCHE INC. (US) 2013-08-27 US disclosed
US-20130045962-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2013-02-21 US disclosed
CN-101917981-B Peptide deformylase inhibitors SMITHKLINE BEECHAM CORP 2012-11-14 CN disclosed
US-7893056-B2 Peptide deformylase inhibitors GLAXOSMITHKLINE LLC (US) 2011-02-22 US disclosed
CN-101917981-A Peptide deformylase inhibitors SMITHKLINE BEECHAM CORP 2010-12-15 CN disclosed
WO-2010071833-A1 PROTEINASE K INHIBITORS, METHODS AND COMPOSITIONS THEREFOR Life Technologies Corporation (US) 2010-06-24 WO disclosed
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS GLAXOSMITHKLINE LLC 2009-12-10 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 (2 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-20130045962-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DPEP1, DHPS DPP4 67/4885DPP7 66/4885FAP 137/4885
US-20090306066-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, DHPS, PADI3 DPP4 180/4885DPP7 259/4885FAP 365/4885

“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.