SCHEMBL4086563

SCHEMBL4086563

COCCCOC1CCN(C(=O)[C@@H](N)Cc2ccc(F)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.51
HRH2 P25021 2/20 0.51
HRH1 P35367 2/20 0.51
FAP Q12884 2/20 0.46
DPP8 Q6V1X1 2/20 0.46
DPP9 Q86TI2 2/20 0.46
DPP7 Q9UHL4 2/20 0.46
LSS P48449 2/20 0.45
F2 P00734 1/20 0.44
PRSS1 P07477 1/20 0.44
AKT1 P31749 3/20 0.44
AKT2 P31751 1/20 0.43
AKT3 Q9Y243 1/20 0.43
AKT1S1 Q96B36 1/20 0.43
OPRD1 P41143 2/20 0.41

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
SCHEMBL3135805 0.94 DPP4 (0.53) DPP4HRH2HRH1FAPDPP8
SCHEMBL4086464 0.85 DPP4 (0.57) DPP4HRH2HRH1FAPDPP8
SCHEMBL3133485 0.81 DPP4 (0.61) DPP4HRH2HRH1FAPDPP8
SCHEMBL3127940 0.81 DPP4 (0.55) DPP4HRH2HRH1FAPDPP8
SCHEMBL3140377 0.79 LSS (0.47) HRH2HRH1LSSOPRD1
SCHEMBL3140366 0.78 LSS (0.46) LSS
SCHEMBL2606751 0.78 DPP4 (0.62) DPP4HRH2HRH1FAPDPP8
SCHEMBL4327505 0.78 DPP4 (0.62) DPP4HRH2HRH1FAPDPP8
SCHEMBL2606773 0.78 DPP4 (0.62) DPP4HRH2HRH1FAPDPP8
SCHEMBL3140707 0.78 DPP4 (0.65) DPP4HRH2HRH1FAPDPP8

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-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2009-01-22 US disclosed
US-7405210-B2 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase OSI PHARMACEUTICALS, INC. (US) 2008-07-29 US disclosed
US-20070244090-A9 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSPHORYLASE BRADLEY STUART E 2007-10-18 US disclosed
US-20050261272-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2005-11-24 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 (3 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-20070244090-A9 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSPHORYLASE PYGL, PYGM, PYGB DPP4 226/4885HRH2 2196/4885HRH1 2348/4885
US-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB DPP4 226/4885HRH2 2196/4885HRH1 2348/4885
US-20050261272-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB DPP4 226/4885HRH2 2196/4885HRH1 2348/4885

“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.