SCHEMBL8232124

SCHEMBL8232124

CC(C)C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)C1CCCCC1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.57
DPP7 Q9UHL4 6/20 0.57
DPP8 Q6V1X1 3/20 0.57
DPP9 Q86TI2 2/20 0.57
FAP Q12884 1/20 0.57
KCNH2 Q12809 1/20 0.44
ACE P12821 2/20 0.43
REN P00797 1/20 0.43

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
SCHEMBL12340713 1.00 DPP4 (0.57) DPP4DPP7DPP8DPP9FAP
SCHEMBL8258468 0.85 DPP4 (0.60) DPP4DPP7DPP8DPP9FAP
SCHEMBL22798445 0.83 DPP4 (0.61) DPP4DPP7DPP8DPP9FAP
SCHEMBL20681631 0.83 DPP4 (0.61) DPP4DPP7DPP8DPP9FAP
SCHEMBL20681629 0.83 DPP4 (0.61) DPP4DPP7DPP8DPP9FAP
SCHEMBL13049763 0.83 DPP4 (0.61) DPP4DPP7DPP8DPP9FAP
SCHEMBL28660609 0.83 DPP4 (0.61) DPP4DPP7DPP8DPP9FAP
SCHEMBL24440806 0.81 DPP4 (0.56) DPP4DPP7DPP8DPP9FAP
SCHEMBL22811129 0.81 DPP4 (0.56) DPP4DPP7DPP8DPP9FAP
SCHEMBL22209456 0.81 DPP4 (0.56) DPP4DPP7DPP8DPP9FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160250237-A1 SOFT PROTEASE INHIBITORS AND PRO-SOFT FORMS THEREOF BACH BIOSCIENCES, LLC 2016-09-01 US disclosed
US-9192646-B2 Soft protease inhibitors and pro-soft forms thereof TRUSTEES OF TUFTS COLLEGE (US) 2015-11-24 US disclosed
US-20150157684-A1 Soft Protease Inhibitors and Pro-Soft Forms Thereof BACH BIOSCIENCES, LLC 2015-06-11 US disclosed
US-8933056-B2 Soft protease inhibitors and pro-soft forms thereof TRUSTEES OF TUFTS COLLEGE (US) 2015-01-13 US disclosed
US-20140128344-A1 Soft Protease Inhibitors and Pro-Soft Forms Thereof TRUSTEES OF TUFTS COLLEGE (US) 2014-05-08 US disclosed
US-8563533-B2 Soft protease inhibitors and pro-soft forms thereof TRUSTEES OF TUFTS COLLEGE (US) 2013-10-22 US disclosed
US-20130150292-A1 Soft Protease Inhibitors and Pro-Soft Forms Thereof TRUSTEES OF TUFTS COLLEGE (US) 2013-06-13 US disclosed
US-8268880-B2 Soft protease inhibitors and pro-soft forms thereof TRUSTEES OF TUFTS COLLEGE (US) 2012-09-18 US disclosed
US-20090124559-A1 Soft Protease Inhibitors and Pro-Soft Forms Thereof TRUSTEES OF TUFTS COLLEGE OFFICE OF TECHNOLOGY AND INDUSTRY COLLABORATION (US) 2009-05-14 US disclosed
US-20090124559-A1 Soft Protease Inhibitors and Pro-Soft Forms Thereof TRUSTEES OF TUFTS COLLEGE OFFICE OF TECHNOLOGY AND INDUSTRY COLLABORATION (US) 2009-05-14 US disclosed
WO-2007100374-A9 SOFT PROTEASE INHIBITORS AND PRO-SOFT FORMS THEREOF TUFTS COLLEGE (US) 2007-12-06 WO disclosed
WO-2007100374-A2 SOFT PROTEASE INHIBITORS AND PRO-SOFT FORMS THEREOF TRUSTEES OF TUFTS COLLEGE (US) 2007-09-07 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 (5 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-20130150292-A1 Soft Protease Inhibitors and Pro-Soft Forms Thereof PREP, DPP4, PEPD DPP4 2/4885DPP7 8/4885DPP8 13/4885
US-20090124559-A1 Soft Protease Inhibitors and Pro-Soft Forms Thereof PREP, DPP4, PEPD DPP4 2/4885DPP7 8/4885DPP8 13/4885
US-20160250237-A1 SOFT PROTEASE INHIBITORS AND PRO-SOFT FORMS THEREOF PREP, DPP4, PEPD DPP4 2/4885DPP7 8/4885DPP8 13/4885
US-20150157684-A1 Soft Protease Inhibitors and Pro-Soft Forms Thereof PREP, DPP4, PEPD DPP4 2/4885DPP7 8/4885DPP8 13/4885
US-20140128344-A1 Soft Protease Inhibitors and Pro-Soft Forms Thereof PREP, DPP4, PEPD DPP4 2/4885DPP7 8/4885DPP8 13/4885

“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.