SCHEMBL4066845

SCHEMBL4066845

CC(C)(C)OC(=O)NC1Cc2cc(F)ccc2NC1=O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.45
EPHX2 P34913 1/20 0.44
PYGL P06737 6/20 0.40
PYGM P11217 4/20 0.40
NFKB1 P19838 2/20 0.39
NFKB2 Q00653 2/20 0.39
RELA Q04206 2/20 0.39
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
RIPK1 Q13546 3/20 0.36
IDO1 P14902 1/20 0.36
PLG P00747 1/20 0.35

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
SCHEMBL13878893 1.00 GAA (0.45) GAAEPHX2PYGLPYGMNFKB1
SCHEMBL4072157 0.91 EPHX2 (0.46) GAAEPHX2PYGLPYGMNFKB1
SCHEMBL13878889 0.91 EPHX2 (0.46) GAAEPHX2PYGLPYGMNFKB1
SCHEMBL653581 0.86 GAA (0.45) GAAEPHX2PYGLPYGMNFKB1
SCHEMBL5133011 0.86 GAA (0.45) GAAEPHX2PYGLPYGMNFKB1
SCHEMBL653580 0.86 GAA (0.45) GAAEPHX2PYGLPYGMNFKB1
SCHEMBL30767932 0.86 GAA (0.45) GAAEPHX2PYGLPYGMNFKB1
SCHEMBL8210416 0.84 EPHX2 (0.47) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL6177311 0.84 EPHX2 (0.47) GAAEPHX2NFKB1NFKB2RELA
SCHEMBL29270789 0.83 GAA (0.43) GAAEPHX2NFKB1NFKB2RELA

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-20090099176-A1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LIMITED (GB) 2009-04-16 US disclosed
EP-1819332-B1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LTD (GB) 2009-03-11 EP disclosed
EP-1819332-A2 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES Prosidion Limited (GB) 2007-08-22 EP disclosed
WO-2006059164-A2 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LIMITED (GB) 2006-06-08 WO 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 GAA 734/4885EPHX2 1684/4885PYGL 104/4885

“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.