SCHEMBL2606908

SCHEMBL2606908

CN(C)C(=O)[C@H](Cc1ccc(F)cc1)NC(=O)c1cc2cc(C#N)ncc2[nH]1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PYGL P06737 14/20 0.64
ROCK2 O75116 1/20 0.46
ROCK1 Q13464 1/20 0.46
PYGM P11217 1/20 0.44
CYP51A1 Q16850 1/20 0.44
ALB P02768 2/20 0.44
IL2 P60568 2/20 0.44
GPER1 Q99527 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
SCHEMBL2107035 1.00 PYGL (0.64) PYGLROCK2ROCK1PYGMCYP51A1
SCHEMBL2108999 0.91 PYGL (0.68) PYGL
SCHEMBL2107381 0.89 ALB (0.55) PYGLPYGMCYP51A1ALBIL2
SCHEMBL2107378 0.89 ALB (0.55) PYGLPYGMCYP51A1ALBIL2
SCHEMBL13271657 0.87 PYGL (0.66) PYGLROCK2ROCK1PYGMCYP51A1
SCHEMBL2606884 0.87 PYGL (0.66) PYGLROCK2ROCK1PYGMCYP51A1
SCHEMBL2106641 0.86 PYGL (0.47) PYGLPYGMCYP51A1ALBIL2
SCHEMBL2106640 0.86 PYGL (0.47) PYGLPYGMCYP51A1ALBIL2
SCHEMBL2606942 0.83 CYP51A1 (0.56) PYGLPYGMCYP51A1ALBIL2
SCHEMBL2109000 0.83 PYGL (0.67) PYGL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158622-B2 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2012-04-17 US disclosed
US-8158622-B2 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2012-04-17 US disclosed
EP-1636224-B1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSHORYLASE PROSIDION LTD (GB) 2010-07-14 EP disclosed
US-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2009-01-22 US disclosed
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-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-20070244090-A9 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSPHORYLASE BRADLEY STUART E 2007-10-18 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-20070244090-A9 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSPHORYLASE PYGL, PYGM, PYGB PYGL 1/4885ROCK2 2167/4885ROCK1 2179/4885
US-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB PYGL 1/4885ROCK2 2167/4885ROCK1 2179/4885

“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.