SCHEMBL13891430

SCHEMBL13891430

O=C1Nc2ccccc2CC1NC(=O)C1Cc2ccc(Cl)nc2N1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 11/20 0.50
▸ PYGM P11217 9/20 0.50
▸ F11 P03951 1/20 0.46
▸ GAA P10253 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RIPK1 Q13546 5/20 0.37

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
SCHEMBL13891413 0.80 PYGL (0.52) PYGLPYGMF11GAAMAPT
SCHEMBL14641138 0.79 PYGL (0.57) PYGLPYGMF11GAAMAPT
SCHEMBL21740214 0.75 PYGL (0.47) PYGLPYGMF11GAAMAPT
SCHEMBL13878909 0.73 PYGL (0.68) PYGLPYGM
SCHEMBL25329367 0.71 PYGL (0.64) PYGLPYGMGAAMAPTRIPK1
SCHEMBL15541576 0.71 PYGL (0.64) PYGLPYGMGAAMAPTRIPK1
SCHEMBL29900499 0.71 PYGL (0.64) PYGLPYGMGAAMAPTRIPK1
SCHEMBL2837105 0.70 PYGL (0.60) PYGLPYGMF11RIPK1
SCHEMBL2608517 0.70 GAA (0.46) GAAMAPT
SCHEMBL13891446 0.69 PYGL (0.39) PYGLPYGMF11GAARIPK1

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-20090099176-A1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LIMITED (GB) 2009-04-16 — — 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 (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-20090099176-A1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PC, GOT2, PDK1 PYGL 104/4885PYGM 229/4885F11 3189/4885

“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.

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