SCHEMBL8287679

SCHEMBL8287679

O=C(C1C[C@@H](c2ccccc2)CN1)N1CCCC1B(O)O

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 15/20 0.67
HDAC2 Q92769 3/20 0.62
FAP Q12884 6/20 0.52
DPP8 Q6V1X1 3/20 0.52
DPP9 Q86TI2 3/20 0.52
DPP7 Q9UHL4 3/20 0.52
PREP P48147 3/20 0.46

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
SCHEMBL16104907 1.00 DPP4 (0.67) DPP4HDAC2FAPDPP8DPP9
SCHEMBL3179037 1.00 DPP4 (0.67) DPP4HDAC2FAPDPP8DPP9
SCHEMBL8287953 0.81 HRH3 (0.56) DPP4FAPDPP8DPP9DPP7
Hydrochloric Acid SCHEMBL6181888 0.79 DPP4 (0.98) DPP4HDAC2FAPDPP8
Hydrochloric Acid SCHEMBL6185505 0.79 DPP4 (0.98) DPP4HDAC2FAPDPP8
SCHEMBL13347244 0.79 DPP4 (0.70) DPP4FAPDPP8DPP9DPP7
SCHEMBL8285601 0.79 DPP4 (0.70) DPP4FAPDPP8DPP9DPP7
SCHEMBL13347125 0.78 DPP4 (0.65) DPP4FAPDPP8DPP9DPP7
SCHEMBL3195160 0.78 DPP4 (0.65) DPP4FAPDPP8DPP9DPP7
SCHEMBL13347199 0.78 DPP4 (0.50) DPP4FAPDPP8DPP9DPP7

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
US-20100120661-A1 HETEROCYCLIC BORONIC ACID COMPOUNDS PHENOMIX CORPORATION (US) 2010-05-13 US disclosed
US-7674913-B2 Heterocyclic boronic acid compounds PHENOMIX CORPORATION (US) 2010-03-09 US disclosed
EP-1997533-A1 Heterocyclic boronic acid compounds, dipeptidyl peptidase IV inhibitors Phenomix Corporation (US) 2008-12-03 EP disclosed
WO-2005047297-A1 HETEROCYCLIC BORONIC ACID COMPOUNDS PHENOMIX CORPORATION (US) 2005-05-26 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-20100120661-A1 HETEROCYCLIC BORONIC ACID COMPOUNDS DPP4, DPP7, DPP3 DPP4 1/4885HDAC2 405/4885FAP 238/4885

“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.