SCHEMBL15028167

SCHEMBL15028167

C[C@H](NC(=S)[C@@H](N)C1CCCCC1)B(O)O

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 13/20 0.55
▸ DPP8 Q6V1X1 4/20 0.36
▸ DPP9 Q86TI2 4/20 0.36
▸ FAP Q12884 2/20 0.36
▸ DPP7 Q9UHL4 2/20 0.36
▸ CA12 O43570 2/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ MMP2 P08253 2/20 0.33
▸ CA9 Q16790 2/20 0.33
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL17814216 0.80 DPP4 (0.55) DPP4DPP8DPP9FAPDPP7
SCHEMBL15028136 0.76 DPP4 (0.39) DPP4DPP8DPP9FAPDPP7
SCHEMBL15028132 0.76 DPP4 (0.38) DPP4DPP8DPP9FAPDPP7
SCHEMBL15028118 0.72 DPP4 (1.00) DPP4DPP8DPP9FAPDPP7
SCHEMBL12340738 0.72 DPP4 (1.00) DPP4DPP8DPP9FAPDPP7
SCHEMBL13295506 0.69 DPP4 (0.41) DPP4DPP8DPP9FAPDPP7
SCHEMBL8230404 0.69 DPP4 (0.34) DPP4DPP8DPP9FAPDPP7
SCHEMBL12340737 0.69 DPP4 (1.00) DPP4DPP8DPP9FAPDPP7
SCHEMBL15028064 0.69 DPP4 (1.00) DPP4DPP8DPP9FAPDPP7
SCHEMBL15028166 0.66 DPP4 (0.66) DPP4DPP8DPP9FAPDPP7

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-20160250237-A1 SOFT PROTEASE INHIBITORS AND PRO-SOFT FORMS THEREOF BACH BIOSCIENCES, LLC 2016-09-01 — — 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

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-20130150292-A1 Soft Protease Inhibitors and Pro-Soft Forms Thereof PREP, DPP4, PEPD DPP4 2/4885DPP8 13/4885DPP9 12/4885
US-20160250237-A1 SOFT PROTEASE INHIBITORS AND PRO-SOFT FORMS THEREOF PREP, DPP4, PEPD DPP4 2/4885DPP8 13/4885DPP9 12/4885

“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.

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