SCHEMBL4086820

SCHEMBL4086820

N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](O)C1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 3/20 0.59
OPRD1 P41143 2/20 0.59
DPP4 P27487 5/20 0.55
DPP7 Q9UHL4 4/20 0.55
POLB P06746 1/20 0.55
DPP8 Q6V1X1 2/20 0.53
DPP9 Q86TI2 2/20 0.53
FAP Q12884 1/20 0.53
TACR1 P25103 1/20 0.51

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
SCHEMBL4095232 1.00 HDAC8 (0.59) HDAC8OPRD1DPP4DPP7POLB
SCHEMBL6052747 1.00 HDAC8 (0.59) HDAC8OPRD1DPP4DPP7POLB
SCHEMBL6161830 0.92 OPRD1 (0.65) HDAC8OPRD1DPP4DPP7POLB
SCHEMBL3133533 0.92 OPRD1 (0.65) HDAC8OPRD1DPP4DPP7POLB
Hydrochloric Acid SCHEMBL6162439 0.91 HDAC8 (0.58) HDAC8OPRD1DPP4DPP7POLB
Hydrochloric Acid SCHEMBL6163301 0.90 HDAC8 (0.63) HDAC8OPRD1DPP4DPP7POLB
Hydrochloric Acid SCHEMBL6165745 0.90 HDAC8 (0.63) HDAC8OPRD1DPP4DPP7POLB
Hydrochloric Acid SCHEMBL6163295 0.90 HDAC8 (0.63) HDAC8OPRD1DPP4DPP7POLB
SCHEMBL27545467 0.88 HDAC8 (0.66) HDAC8OPRD1DPP4DPP7POLB
SCHEMBL6052908 0.88 HDAC8 (0.66) HDAC8OPRD1DPP4DPP7POLB

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 HDAC8 1898/4885OPRD1 3457/4885DPP4 226/4885
US-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB HDAC8 1898/4885OPRD1 3457/4885DPP4 226/4885
US-20050261272-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB HDAC8 1898/4885OPRD1 3457/4885DPP4 226/4885

“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.