SCHEMBL13878922

SCHEMBL13878922

C[S+]([O-])CCN1C(=O)C(NC(=O)c2cc3cc(Cl)ncc3[nH]2)Cc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 20/20 0.61
▸ PYGM P11217 6/20 0.55
▸ ABCB11 O95342 1/20 0.54

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
SCHEMBL13878915 0.89 PYGL (0.77) PYGLPYGMABCB11
SCHEMBL13878926 0.89 PYGL (0.66) PYGLPYGMABCB11
SCHEMBL13878925 0.89 PYGL (0.77) PYGLPYGMABCB11
SCHEMBL5642772 0.88 PYGL (0.79) PYGLPYGMABCB11
SCHEMBL13878952 0.88 PYGL (0.69) PYGLPYGMABCB11
SCHEMBL13878954 0.87 PYGL (0.62) PYGLPYGMABCB11
SCHEMBL5316470 0.87 PYGL (0.69) PYGLPYGMABCB11
SCHEMBL13878920 0.87 PYGL (0.69) PYGLPYGMABCB11
SCHEMBL13878923 0.87 PYGL (0.70) PYGLPYGMABCB11
SCHEMBL13878928 0.87 PYGL (0.62) PYGLPYGMABCB11

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 2 patents. 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
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 229/4885ABCB11 1542/4885

“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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