SCHEMBL3142015

SCHEMBL3142015

NC(=O)C1C(O)C(O)CN1C(=O)[CH]Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.40
TACR1 P25103 1/20 0.36
GBA1 P04062 3/20 0.35
SIRT1 Q96EB6 1/20 0.35
GAA P10253 3/20 0.35
MAPK1 P28482 1/20 0.34
ABCB1 P08183 1/20 0.33
PYGL P06737 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MMP3 P08254 2/20 0.32
MMP9 P14780 2/20 0.32
ADAM17 P78536 2/20 0.32
MMP1 P03956 1/20 0.32

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
SCHEMBL6052894 1.00 FUCA1 (0.40) FUCA1TACR1GBA1SIRT1GAA
SCHEMBL6052770 1.00 FUCA1 (0.40) FUCA1TACR1GBA1SIRT1GAA
SCHEMBL6052774 1.00 FUCA1 (0.40) FUCA1TACR1GBA1SIRT1GAA
SCHEMBL6052771 1.00 FUCA1 (0.40) FUCA1TACR1GBA1SIRT1GAA
SCHEMBL3094922 0.92 TACR1 (0.38) FUCA1TACR1SIRT1GAAMAPK1
SCHEMBL6704820 0.92 TACR1 (0.38) FUCA1TACR1SIRT1GAAMAPK1
SCHEMBL4086816 0.82 TACR1 (0.44) TACR1GBA1GAACYP2C19SMN1; SMN2
SCHEMBL6052746 0.82 TACR1 (0.44) TACR1GBA1GAACYP2C19SMN1; SMN2
SCHEMBL4095230 0.82 TACR1 (0.44) TACR1GBA1GAACYP2C19SMN1; SMN2
SCHEMBL6052769 0.80 TACR1 (0.38) FUCA1TACR1GBA1SIRT1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-20050261272-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2005-11-24 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 (3 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 FUCA1 1960/4885TACR1 3420/4885GBA1 729/4885
US-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB FUCA1 1960/4885TACR1 3420/4885GBA1 729/4885
US-20050261272-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB FUCA1 1960/4885TACR1 3420/4885GBA1 729/4885

“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.