SCHEMBL2107425

SCHEMBL2107425

CON(C)C(=O)C(Cc1ccc(F)cc1)NC(=O)c1cc2cc(Cl)ncc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PYGL P06737 14/20 0.54
CYP51A1 Q16850 2/20 0.47
PYGM P11217 1/20 0.47
ALB P02768 1/20 0.43
IL2 P60568 1/20 0.43
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 1/20 0.42

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
SCHEMBL2606838 1.00 PYGL (0.54) PYGLCYP51A1PYGMALBIL2
SCHEMBL2606884 0.91 PYGL (0.66) PYGLCYP51A1PYGMROCK2ROCK1
SCHEMBL2606968 0.88 PYGL (0.51) PYGLCYP51A1PYGMALBIL2
SCHEMBL2607058 0.88 PYGL (0.54) PYGLCYP51A1PYGMALBIL2
SCHEMBL2108843 0.87 PYGL (0.51) PYGLCYP51A1PYGMROCK2ROCK1
SCHEMBL2606974 0.87 PYGL (0.51) PYGLCYP51A1PYGMROCK2ROCK1
SCHEMBL2606819 0.85 PYGL (0.52) PYGLCYP51A1PYGMALBIL2
SCHEMBL2106634 0.85 PYGL (0.59) PYGLCYP51A1PYGMALBIL2
SCHEMBL2106631 0.85 PYGL (0.59) PYGLCYP51A1PYGMALBIL2
SCHEMBL2607056 0.85 PYGL (0.51) PYGLCYP51A1PYGMALBIL2

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 1 patent. 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